Starting date and time: Sat Aug 10 21:26:28 CEST 2019 Calculation run on nodes/processors: *** SPO-DVR program version 5.16 (Compiled using IFORT for X86 on Jul 5 2019 at 10:16:08) run on 20190810 at 212628.791 *** * Using the new style input format... * OpenMP enabled ... * MPI disabled ... * NAG calls disabled ... * FFTW library will be used for FFTs ... * Estimate FFTW plans will be used for FFTs ... * Generic code will be used for diagonalizations ... * Extra check calls enabled ... * The internal timers of module Timers are not used ... * The FFT over R is performed using a single call ... * Full potential energy operation optimization has been enabled... * Potential energy multiplication optimization has been disabled... * Kinetic energy multiplication optimization has been disabled ... * Optimization of the kinetic energy operator routine in Z on the scattering grid has been disabled ... * Setting up global data... * Calculated machines precision: 0.55511151E-16 * Using a maximum number of 32 threads in this run. * Setting up global data... * Preparing module inputfields for reading the input file ... * Trying to read input file "DVR.inp" ... * Input file read OK ... *** THE INPUT PARAMETERS SETUP INTERNALLY BY THE PROGRAM *** * The surface lattice constant in X (bohr): 0.48638932E+01 * The surface lattice constant in Y (bohr): 0.48638932E+01 * The asymptotic value in Z (bohr): 0.15117808E+02 * The cutoff value in r (bohr): 0.10000000E+04 * The unit cell skewing angle (degrees): 0.60000000E+02 * The unit cell point group: C3v NOTE: If the potential switching option is used to switch the potential faster to the gas phase, the Z-value at which the potential first reaches the gas phase, is the new asymptotic Z-value. *** THE INPUT READ *** * Title: v0j8mj0-0.15eV-0.55eV * SystemID: CRPlibrary * NewCalc: T * Z degree of freedom: T * R degree of freedom: T * X degree of freedom: T * Y degree of freedom: T * Theta degree of freedom: T * Phi degree of freedom: T * Mass of atom 1 (amu): 0.10078000E+01 * Mass of atom 2 (amu): 0.10078000E+01 * Homo-nuclear molecule: T * Number of points on the scattering grid in Z: 198 * Step size of the scattering Z (bohr): 0.10000000E+00 * Starting point of the scattering in Z (bohr): -0.10000000E+01 * Number of points on the specular grid in Z: 252 * Number of points on the scattering grid in r: 56 * Step size of the scattering r (bohr): 0.15000000E+00 * Starting point of the scattering in r (bohr): 0.80000000E+00 * Specular grid in r is identical to the scattering grid in r. * Number of points on the scattering grid in X: 20 * Number of points on the scattering grid in Y: 20 * Maximum J value in grid representation.: 32 * Maximum Mj value in grid representation.: 32 * The projection operator scheme used: using two grids all the way * Propagation method used: Split operator * Calculation starts at (aut): 0.00000000E+00 * Calculation ends at (aut): 0.20000000E+05 * Time step used in the propagation (aut): 0.20000000E+01 * Number of time steps taken: 10000 * Only performing a fine analysis: F * Also performing a fine analysis: T * Wave function analysed every (aut): 0.50000000E+02 * Averages printed every (aut): 0.50000000E+02 * Initially using a dynamical specular analysis surface: T * Wave function analysed at (bohr): 0.15200000E+02 * Maximum J analysed: determined by the program (see info Analysis) * Maximum V analysed: determined by the program (see info Analysis) * Maximum diffraction order analysed: determined by the program (see info Analysis) * Number of energies that are on-the-fly analysed: 8 * Lowest energy of the initial wave packet: 0.15000000E+00 * Highest energy of the initial wave packet: 0.55000000E+00 * Average position of the initial wave packet: 0.17400000E+02 * Initial rotational quantum number J: 8 * Initial rotational quantum number Mj: 0 * Initial rotational quantum number V: 0 * Only computing the potential: F * Imposing a minimum value on the potential: F * Imposing a maximum value on the potential: T * Maximum value imposed on the potential: 0.10000000E+02 * Using symmetry in setting up the potential: F * Potential mixing alfa value: 0.00000000E+00 * Using a quadratic optical potential on the scattering grid in Z: * Optical potential in Z start at (bohr): 0.15200000E+02 * Optical potential in Z ends at (bohr): 0.18700000E+02 * Optical potential in Z absorbs optimally for (eV): 0.10000000E+00 * Using a quadratic optical potential on the scattering grid in r: * Optical potential in r start at (bohr): 0.45500000E+01 * Optical potential in r ends at (bohr): 0.90500000E+01 * Optical potential in r absorbs optimally for (eV): 0.10000000E+00 * Using a quadratic optical potential on the specular grid in Z: * Optical potential in Z start at (bohr): 0.19800000E+02 * Optical potential in Z ends at (bohr): 0.24100000E+02 * Optical potential in Z specular absorbs optimally for (eV 0.80000000E-01 * Initial energy parallel to the surface (eV): 0.00000000E+00 * Azimuthal angle of the incident molecule (degrees): 0.00000000E+00 * Using a switching function for the potential in Z: F * Switching function starts at (bohr): 0.65000000E+01 * Switching function ends at (bohr): 0.70000000E+01 * S-matrix elements written to file 3: T * Rot-vib-diff resolved probs written to file 25: T * Rot-diff resolved probs written to file 10: T * Dumping debug information to file: F * Dumping full S-matrix to file fil10: F * Tolerance for transferring the wavefunction (nproj = 2): 0.10000000E-08 * Validating the input... * Processing the input... *** THE INPUT FOR ROTATIONAL DEGREES OF FREEDOM *** * J in: 8 * Mj in: 0 * Maximum J value in grid rep.: 32 * HomeNuclear: T * A general MjIn independant grid will be used ... *** CONTINUING SETUP I *** * Setting up the FFT module ... * Setting up legendre module with JMax + 1 = 33 ... * Setting up the angular grid module with JMax = 32 ... * The nearest size allowed by FFT routines ( 66 ) for phi grid will be used ... * Setting up the angular grid and basis functions... *** THE GRID PARAMETERS *** * Number of phi's : 66 * Delta value in phi coordinate : 9.519977738150888E-002 * Number of theta's : 17 * JMax in basis set : 32 * JMin in basis set : 0 * Delta J in basis set : 2 * Grid has been set up for JIn = 8 , MjIn = 0 ... *** CONTINUING SETUP II *** * Setting up the angular DVR/FBR transform module and the transformation matric es ... *** SETUP DONE *** ******************************************************************************** INFO FROM MISCELLANEOUS SETUP ******************************************************************************** grid interval size in kz dir. (scat. grid) = 0.317333 grid interval size in kz dir. (spec. grid) = 0.249333 initial momentum in z direction = 9.275865 grid interval size in kr dir. = 0.747998 grid interval size in kx dir. = 1.491644 initial momentum in reciprocal x direction = 0.000000 grid interval size in ky dir. = 1.491644 initial momentum in reciprocal y direction = 0.000000 For backward compatibility: nmoder = 4 asymptotic analysis at z = 15.200000 No flux analysis performed. nzpot = 162 optical potential in z scat.grid: nzchsp = 163 z(nzchsp)= 15.200000 optical potential in z scat.grid: nzchmx = 198 z(nzchmx)= 18.700000 optical potential in z spec.grid: nschsp = 209 z(nschsp)= 19.800000 optical potential in z spec.grid: nschmx = 252 z(nschmx)= 24.100000 optical potential in r scat.grid: nrchsp = 26 r(nrchsp)= 4.550000 optical potential in r scat.grid: nrchmx = 56 r(nrchmx)= 9.050000 max kinetic energy in r (ev) = 6.497306 with current time interval in the analysis the max total energy for which results can be obtained (eV) = 1.709743 zero of etot is energy lowest h2 state the 95% confidence interval defined by alfwv and enrgy: ectmin (ev) = 0.150000 ectmax (ev) = 0.550000 Total time for potential initialisation = 0.34093857E-04 secs * Grids are setup! * 5-Mode arrays are allocated! * 4-Mode arrays are allocated! ******************************************************************************** INFO FROM SETTING UP THE INTERACTION POTENTIAL ******************************************************************************** * Setting up the Cu111_B86SRP68-DF2_Z8A_C3v PES... Number of points in Z for which the potential is calculated = 162 Number of points in r for which the potential is calculated = 56 Number of points in x for which the potential is calculated = 20 Number of points in y for which the potential is calculated = 20 Number of points in theta for which the potential is calculated = 17 Number of points in phi for which the potential is calculated = 66 iz = 1 iz = 2 iz = 3 iz = 4 iz = 5 iz = 6 iz = 7 iz = 8 iz = 9 iz = 10 iz = 11 iz = 12 iz = 13 iz = 14 iz = 15 iz = 16 iz = 17 iz = 18 iz = 19 iz = 20 iz = 21 iz = 22 iz = 23 iz = 24 iz = 25 iz = 26 iz = 27 iz = 28 iz = 29 iz = 30 iz = 31 iz = 32 iz = 33 iz = 34 iz = 35 iz = 36 iz = 37 iz = 38 iz = 39 iz = 40 iz = 41 iz = 42 iz = 43 iz = 44 iz = 45 iz = 46 iz = 47 iz = 48 iz = 49 iz = 50 iz = 51 iz = 52 iz = 53 iz = 54 iz = 55 iz = 56 iz = 57 iz = 58 iz = 59 iz = 60 iz = 61 iz = 62 iz = 63 iz = 64 iz = 65 iz = 66 iz = 67 iz = 68 iz = 69 iz = 70 iz = 71 iz = 72 iz = 73 iz = 74 iz = 75 iz = 76 iz = 77 iz = 78 iz = 79 iz = 80 iz = 81 iz = 82 iz = 83 iz = 84 iz = 85 iz = 86 iz = 87 iz = 88 iz = 89 iz = 90 iz = 92 iz = 91 iz = 93 iz = 94 iz = 96 iz = 95 iz = 97 iz = 98 iz = 100 iz = 99 iz = 101 iz = 102 iz = 104 iz = 103 iz = 105 iz = 106 iz = 108 iz = 107 iz = 109 iz = 110 iz = 112 iz = 111 iz = 113 iz = 114 iz = 116 iz = 115 iz = 117 iz = 118 iz = 120 iz = 119 iz = 121 iz = 122 iz = 124 iz = 123 iz = 125 iz = 126 iz = 128 iz = 127 iz = 129 iz = 130 iz = 132 iz = 131 iz = 133 iz = 134 iz = 136 iz = 135 iz = 137 iz = 138 iz = 140 iz = 139 iz = 141 iz = 142 iz = 144 iz = 148 iz = 152 iz = 156 iz = 160 iz = 145 iz = 149 iz = 153 iz = 157 iz = 161 iz = 146 iz = 150 iz = 154 iz = 143 iz = 158 iz = 162 iz = 147 iz = 151 iz = 155 iz = 159 Saving Cu111_B86SRP68-DF2_Z8A_C3v PES into file : ./Cu111_B86SRP68-DF2_Z8A_C3v_162_-1.000_0.100_56_0.800_0.150_20_20_4.864_32_32. pes WARNING in routine SetupThePES in module Potential: vdvr contains more indices than can be represented by a four byte integer. Therefore the result of the inquiry 'SIZE(vdvr)' will be wrong! Program continues with dirty trick fix. Beware! * Imposing a maximum on the potential; vmax (eV) = 0.10000000E+02 Total time setting up the potential = 0.31669049E+04 secs ******************************************************************************** INFO FROM SETTING UP THE ROVIBARIONAL ASYMPTOTIC POTENTIAL ******************************************************************************** The gas phase vibrational potential for Z = 15.1178079086314 r(Bohr) V(eV) --------------------------------------------- 0.800000000000000 -0.614313158203822 0.950000000000000 -3.19102266083849 1.10000000000000 -4.45136825777271 1.25000000000000 -4.99984753548742 1.40000000000000 -5.15222895836725 1.55000000000000 -5.07205461356338 1.70000000000000 -4.85412985260776 1.85000000000000 -4.55365640658986 2.00000000000000 -4.20965954065202 2.15000000000000 -3.84476515750003 2.30000000000000 -3.47295832873381 2.45000000000000 -3.10772368458484 2.60000000000000 -2.75591917705669 2.75000000000000 -2.41910500293411 2.90000000000000 -2.09869395800417 3.05000000000000 -1.79612193194245 3.20000000000000 -1.51285210467923 3.35000000000000 -1.25033926714185 3.50000000000000 -1.00917613430596 3.65000000000000 -0.788439939242043 3.80000000000000 -0.587054085255137 3.95000000000000 -0.403941975650272 4.10000000000000 -0.238027013732485 4.25000000000000 -8.823260280680591E-002 4.40000000000000 -8.846257060213248E-013 4.55000000000000 -8.846257060213248E-013 4.70000000000000 -8.846257060213248E-013 4.85000000000000 -8.846257060213248E-013 5.00000000000000 -8.846257060213248E-013 5.15000000000000 -8.846257060213248E-013 5.30000000000000 -8.846257060213248E-013 5.45000000000000 -8.846257060213248E-013 5.60000000000000 -8.846257060213248E-013 5.75000000000000 -8.846257060213248E-013 5.90000000000000 -8.846257060213248E-013 6.05000000000000 -8.846257060213248E-013 6.20000000000000 -8.846257060213248E-013 6.35000000000000 -8.846257060213248E-013 6.50000000000000 -8.846257060213248E-013 6.65000000000000 -8.846257060213248E-013 6.80000000000000 -8.846257060213248E-013 6.95000000000000 -8.846257060213248E-013 7.10000000000000 -8.846257060213248E-013 7.25000000000000 -8.846257060213248E-013 7.40000000000000 -8.846257060213248E-013 7.55000000000000 -8.846257060213248E-013 7.70000000000000 -8.846257060213248E-013 7.85000000000000 -8.846257060213248E-013 8.00000000000000 -8.846257060213248E-013 8.15000000000000 -8.846257060213248E-013 8.30000000000000 -8.846257060213248E-013 8.45000000000000 -8.846257060213248E-013 8.60000000000000 -8.846257060213248E-013 8.75000000000000 -8.846257060213248E-013 8.90000000000000 -8.846257060213248E-013 9.05000000000000 -8.846257060213248E-013 * Imposing a maximum on the potential; vmax (eV) = 0.10000000E+02 ******************************************************************************** INFO FROM SETTING UP THE ASYMPTOTIC ROVIBRATIONAL STATES ******************************************************************************** asymptotic molecular vibrational wave functions v j e(ev) erel(ev) psi(1) psi(nr) norm 0 0 -4.886560 -0.495022 0.1108407D-01 0.6766701D-03 1.0000000 1.4592222 0 1 -4.872088 -0.480550 0.1074900D-01 0.6544072D-03 1.0000000 1.4614064 0 2 -4.843277 -0.451739 0.1010829D-01 0.6120063D-03 1.0000000 1.4657641 0 3 -4.800385 -0.408847 0.9216637D-02 0.5533927D-03 1.0000000 1.4722741 0 4 -4.743793 -0.352255 0.8146544D-02 0.4837088D-03 1.0000000 1.4809057 0 5 -4.673990 -0.282452 0.6978806D-02 0.4085885D-03 1.0000000 1.4916191 0 6 -4.591560 -0.200022 0.5792699D-02 0.3334277D-03 1.0000000 1.5043673 0 7 -4.497167 -0.105629 0.4657444D-02 0.2627771D-03 1.0000000 1.5190968 0 8 -4.391538 0.000000 0.3626184D-02 0.1999469D-03 1.0000000 1.5357497 0 9 -4.275447 0.116091 0.2733089D-02 0.1468600D-03 1.0000000 1.5542650 0 10 -4.149699 0.241839 0.1993548D-02 0.1041307D-03 1.0000000 1.5745804 0 11 -4.015115 0.376423 0.1406814D-02 0.7131162D-04 1.0000000 1.5966338 0 12 -3.872520 0.519018 0.9601839D-03 0.4722808D-04 1.0000000 1.6203649 0 13 -3.722731 0.668807 0.6336524D-03 0.3032238D-04 1.0000000 1.6457168 0 14 -3.566546 0.824993 0.4042006D-03 0.1895074D-04 1.0000000 1.6726370 0 15 -3.404739 0.986799 0.2491495D-03 0.1159880D-04 1.0000000 1.7010784 0 16 -3.238056 1.153482 0.1483557D-03 0.7007247D-05 1.0000000 1.7310003 0 17 -3.067207 1.324331 0.8530722D-04 0.4216678D-05 1.0000000 1.7623681 0 18 -2.892866 1.498672 0.4735220D-04 0.2552000D-05 1.0000000 1.7951540 0 19 -2.715668 1.675870 0.2535977D-04 0.1570764D-05 1.0000000 1.8293366 0 20 -2.536212 1.855326 0.1309290D-04 0.9984743D-06 1.0000000 1.8649010 0 21 -2.355055 2.036483 0.6506324D-05 0.6687072D-06 1.0000000 1.9018391 0 22 -2.172720 2.218818 0.3103067D-05 0.4784094D-06 1.0000000 1.9401511 0 23 -1.989692 2.401846 0.1413474D-05 0.3609022D-06 1.0000000 1.9798469 0 24 -1.806422 2.585116 0.6108915D-06 0.2730916D-06 1.0000000 2.0209484 0 25 -1.623330 2.768208 0.2496658D-06 0.1905184D-06 1.0000000 2.0634922 0 26 -1.440808 2.950730 0.9869287D-07 0.1043847D-06 1.0000000 2.1075305 0 27 -1.259222 3.132316 0.4237105D-07 0.1735779D-07 1.0000000 2.1531306 0 28 -1.078916 3.312622 -0.2502810D-07 0.6205393D-07 1.0000000 2.2003723 0 29 -0.900213 3.491325 -0.2121238D-07 0.1249720D-06 1.0000000 2.2493422 0 30 -0.723415 3.668123 -0.2031340D-07 0.1657846D-06 1.0000000 2.3001271 0 31 -0.548804 3.842735 -0.1871562D-07 0.1833134D-06 1.0000000 2.3528071 0 32 -0.376639 4.014900 -0.1582985D-07 0.1800695D-06 1.0000000 2.4074525 1 0 -4.377131 0.014408 0.2956956D-01 0.2094185D-02 1.0000000 1.5567653 1 1 -4.363394 0.028144 0.2872491D-01 0.2028557D-02 1.0000000 1.5589873 1 2 -4.336044 0.055494 0.2710458D-01 0.1903183D-02 1.0000000 1.5634221 1 3 -4.295327 0.096212 0.2483768D-01 0.1728998D-02 1.0000000 1.5700508 1 4 -4.241599 0.149939 0.2209741D-01 0.1520482D-02 1.0000000 1.5788466 1 5 -4.175323 0.216215 0.1908004D-01 0.1293749D-02 1.0000000 1.5897747 1 6 -4.097050 0.294488 0.1598258D-01 0.1064561D-02 1.0000000 1.6027943 1 7 -4.007410 0.384128 0.1298220D-01 0.8466080D-03 1.0000000 1.6178591 1 8 -3.907091 0.484448 0.1022065D-01 0.6502907D-03 1.0000000 1.6349192 1 9 -3.796830 0.594709 0.7795213D-02 0.4821432D-03 1.0000000 1.6539220 1 10 -3.677394 0.714144 0.5756893D-02 0.3448852D-03 1.0000000 1.6748131 1 11 -3.549570 0.841968 0.4114855D-02 0.2379758D-03 1.0000000 1.6975372 1 12 -3.414146 0.977392 0.2845305D-02 0.1584757D-03 1.0000000 1.7220385 1 13 -3.271907 1.119631 0.1902477D-02 0.1020129D-03 1.0000000 1.7482614 1 14 -3.123619 1.267919 0.1229541D-02 0.6367986D-04 1.0000000 1.7761507 1 15 -2.970025 1.421513 0.7677620D-03 0.3874540D-04 1.0000000 1.8056544 1 16 -2.811840 1.579698 0.4630331D-03 0.2312868D-04 1.0000000 1.8367256 1 17 -2.649741 1.741797 0.2696261D-03 0.1363161D-04 1.0000000 1.8693275 1 18 -2.484372 1.907166 0.1515515D-03 0.7964809D-05 1.0000000 1.9034382 1 19 -2.316341 2.075197 0.8220347D-04 0.4625799D-05 1.0000000 1.9390543 1 20 -2.146220 2.245318 0.4300803D-04 0.2699686D-05 1.0000000 1.9761940 1 21 -1.974553 2.416985 0.2167862D-04 0.1649070D-05 1.0000000 2.0148935 1 22 -1.801852 2.589686 0.1049672D-04 0.1143608D-05 1.0000000 2.0552011 1 23 -1.628604 2.762934 0.4849161D-05 0.9535120D-06 1.0000000 2.0971646 1 24 -1.455263 2.936275 0.2106913D-05 0.9041519D-06 1.0000000 2.1408178 1 25 -1.282253 3.109285 0.8363547D-06 0.8699011D-06 1.0000000 2.1861690 1 26 -1.109959 3.281579 0.2853172D-06 0.7800547D-06 1.0000000 2.2331972 1 27 -0.938728 3.452810 0.7152578D-07 0.6172292D-06 1.0000000 2.2818597 1 28 -0.768863 3.622676 0.5955816D-08 0.4025537D-06 1.0000000 2.3321141 1 29 -0.600629 3.790909 -0.1855380D-08 0.1736366D-06 1.0000000 2.3839503 1 30 -0.434265 3.957273 -0.7203174D-08 0.3474696D-07 1.0000000 2.4374261 1 31 -0.269989 4.121549 -0.1667264D-07 0.2008302D-06 1.0000000 2.4926969 1 32 -0.108020 4.283518 -0.2151494D-07 0.3169960D-06 1.0000000 2.5500321 2 0 -3.893806 0.497732 0.5771819D-01 0.4751239D-02 1.0000000 1.6575165 2 1 -3.880782 0.510756 0.5615908D-01 0.4609568D-02 1.0000000 1.6597984 2 2 -3.854850 0.536688 0.5315887D-01 0.4338129D-02 1.0000000 1.6643531 2 3 -3.816243 0.575296 0.4894017D-01 0.3959188D-02 1.0000000 1.6711626 2 4 -3.765299 0.626239 0.4380517D-01 0.3502542D-02 1.0000000 1.6802002 2 5 -3.702455 0.689083 0.3810226D-01 0.3001846D-02 1.0000000 1.6914311 2 6 -3.628235 0.763304 0.3218887D-01 0.2490697D-02 1.0000000 1.7048133 2 7 -3.543232 0.848306 0.2639577D-01 0.1999073D-02 1.0000000 1.7202983 2 8 -3.448099 0.943439 0.2099758D-01 0.1550658D-02 1.0000000 1.7378329 2 9 -3.343534 1.048005 0.1619351D-01 0.1161345D-02 1.0000000 1.7573614 2 10 -3.230260 1.161278 0.1209991D-01 0.8389907D-03 1.0000000 1.7788292 2 11 -3.109020 1.282518 0.8754491D-02 0.5842474D-03 1.0000000 1.8021864 2 12 -2.980561 1.410977 0.6129547D-02 0.3921294D-03 1.0000000 1.8273924 2 13 -2.845627 1.545911 0.4150647D-02 0.2539269D-03 1.0000000 1.8544197 2 14 -2.704953 1.686585 0.2716632D-02 0.1591155D-03 1.0000000 1.8832547 2 15 -2.559257 1.832281 0.1717553D-02 0.9700017D-04 1.0000000 1.9138957 2 16 -2.409239 1.982299 0.1048338D-02 0.5794320D-04 1.0000000 1.9463452 2 17 -2.255573 2.135965 0.6174369D-03 0.3411118D-04 1.0000000 1.9806003 2 18 -2.098905 2.292633 0.3507947D-03 0.1975138D-04 1.0000000 2.0166416 2 19 -1.939841 2.451697 0.1922546D-03 0.1106586D-04 1.0000000 2.0544251 2 20 -1.778945 2.612593 0.1016680D-03 0.5806463D-05 1.0000000 2.0938824 2 21 -1.616734 2.774804 0.5189138D-04 0.2750023D-05 1.0000000 2.1349296 2 22 -1.453671 2.937867 0.2554657D-04 0.1212388D-05 1.0000000 2.1774871 2 23 -1.290177 3.101362 0.1208783D-04 0.7130541D-06 1.0000000 2.2215056 2 24 -1.126630 3.264908 0.5441000D-05 0.8240646D-06 1.0000000 2.2669927 2 25 -0.963384 3.428154 0.2274031D-05 0.1161683D-05 1.0000000 2.3140301 2 26 -0.800777 3.590761 0.8340432D-06 0.1439803D-05 1.0000000 2.3627752 2 27 -0.639142 3.752396 0.2271824D-06 0.1510905D-05 1.0000000 2.4134430 2 28 -0.478807 3.912731 0.6553576D-08 0.1358787D-05 1.0000000 2.4662759 2 29 -0.320101 4.071437 -0.4767921D-07 0.1049775D-05 1.0000000 2.5215137 2 30 -0.163340 4.228198 -0.4035016D-07 0.6729239D-06 1.0000000 2.5793812 2 31 -0.008828 4.382710 -0.1809269D-07 0.2977293D-06 1.0000000 2.6401056 2 32 0.143150 4.534689 -0.8700250D-09 0.4330716D-07 1.0000000 2.7039613 energy initial v,j state = -4.391538 potential energy = -4.987158 rotational energy = 0.470085 vibrational energy = 0.125535 rovibrational energy = 0.595619 expectation value r = 1.535750 ******************************************************************************** INFO FROM SETTING UP THE DIFFRACTION BASIS ******************************************************************************** WARNING: Diffractional basis too small to describe all open channels! 400 diffraction channels in basis (ndftow) * Number of diffraction states analysed, ndifa = 271 * Highest diffraction order, maxord = 19 * Largest number of diffraction states that belong to the same diffraction order, maxnum = 54 ******************************************************************************** INFO FROM SETTING UP THE ROTATION BASIS ******************************************************************************** 561 rotation channels in basis (nrotw) * number of rotational states analysed, nana = 91 * initial rotational state in basis, ichn = 277 ******************************************************************************** INFO FROM SETTING UP THE ROTATION-DIFFRACTION BASIS ******************************************************************************** ***** rotation-diffraction channels in basis (nstatw) * Number of rotation-diffraction analysed, nstata = 24661 * Index of initial rot-dif channel in basis, inchna = 12467 ******************************************************************************** INFO FROM SETTING UP THE OPTICAL POTENTIALS ******************************************************************************** * Optical potential in Z absorbs with coefficient: 0.83111374E-02 * Optical potential in r absorbs with coefficient: 0.93569763E-02 * Optical potential in Z specular absorbs with coefficient: 0.64071284E-02 ******************************************************************************** INFO FROM SETTING UP THE GRID ENERGIES ******************************************************************************** * Maximum diffraction order included on the momentum grid = 0 * Number of diffraction channels included = 0 * Number of diffraction channels excluded = 0 * initial parallel energy (eV) = 0.00000000E+00 ******************************************************************************** INFO FROM SETTING UP THE KINETIC ENERGY OPERATORS ******************************************************************************** ******************************************************************************** INFO FROM SETTING UP THE WAVE FUNCTION ******************************************************************************** * Norm initial wave packet (Z,r) = 0.10000000E+01 * Absolute value of the wave function in momentum space: - at k = 0 0.20426229E-04 - at the end/beginning of the grid 0.20158188E-14 - maximum value = 0.52335254E+00 * Grid point boundaries between which initial wave packet must be located: - Low boundary (asymptotic value of Z), iLow = 163 - High boundary (start of opt. pot on spec. grid), iHigh = 208 * Norm of the initial wave packet between iLow and iHigh = 0.10000000E+01 ******************************************************************************** INFO FROM SETTING UP THE ANALYSIS ******************************************************************************** * Tolerance for fixing the dynamical analysis surface on the specular grid = 0.10000000E-08 * Maximum j in analysis: jana = 12 * Maximum v in analysis: nviba = 3 * Maximum diffraction order in analysis: mdifa = 9 ******************************************************************************** INFO FROM SETTING UP THE SPLIT OPERATOR PROPAGATOR ******************************************************************************** ----- Split operator propagator set up ----- ******************************************************************************** INFO ON PROPAGATING THE WAVE PACKET ******************************************************************************** time norm z r rest norm 0.00000000E+00 1.00000000 17.40000000 1.53574968 0.10000000E+01 0.50000000E+02 0.99999999 17.27377086 1.53575595 0.99999999E+00 0.10000000E+03 0.99999998 17.14754172 1.53576245 0.99999997E+00 0.15000000E+03 0.99999998 17.02131258 1.53576358 0.99999980E+00 0.20000000E+03 0.99999997 16.89508344 1.53576327 0.99999855E+00 0.25000000E+03 0.99999996 16.76885430 1.53576208 0.99998985E+00 0.30000000E+03 0.99999995 16.64262516 1.53575699 0.99993931E+00 0.35000000E+03 0.99999994 16.51639602 1.53575039 0.99969724E+00 0.40000000E+03 0.99999993 16.39016687 1.53575402 0.99874791E+00 0.45000000E+03 0.99999993 16.26393773 1.53576283 0.99569675E+00 0.50000000E+03 0.99999992 16.13770858 1.53576403 0.98760724E+00 0.55000000E+03 0.99999991 16.01147941 1.53576306 0.96972261E+00 0.60000000E+03 0.99999990 15.88525016 1.53576173 0.93629620E+00 0.65000000E+03 0.99999989 15.75902072 1.53575759 0.88265997E+00 0.70000000E+03 0.99999989 15.63279086 1.53575147 0.80756273E+00 0.75000000E+03 0.99999988 15.50656013 1.53575255 0.71431863E+00 0.80000000E+03 0.99999987 15.38032789 1.53576231 0.61003008E+00 0.85000000E+03 0.99999986 15.25409318 1.53576495 0.50340989E+00 0.90000000E+03 0.99999985 15.12785481 1.53576291 0.40241938E+00 0.95000000E+03 0.99999984 15.00161134 1.53576136 0.31270931E+00 0.10000000E+04 0.99999984 14.87536121 1.53575794 0.23716178E+00 0.10500000E+04 0.99999983 14.74910281 1.53575248 0.17627134E+00 0.11000000E+04 0.99999982 14.62283452 1.53575195 0.12891004E+00 0.11500000E+04 0.99999981 14.49655480 1.53576079 0.93104775E-01 0.12000000E+04 0.99999980 14.37026218 1.53576638 0.66633383E-01 0.12500000E+04 0.99999979 14.24395525 1.53576299 0.47394719E-01 0.13000000E+04 0.99999979 14.11763261 1.53576159 0.33589151E-01 0.13500000E+04 0.99999978 13.99129287 1.53575904 0.23771132E-01 0.14000000E+04 0.99999977 13.86493454 1.53575534 0.16830009E-01 0.14500000E+04 0.99999976 13.73855597 1.53575551 0.11939073E-01 0.15000000E+04 0.99999975 13.61215533 1.53576534 0.84968641E-02 0.15500000E+04 0.99999975 13.48573051 1.53577678 0.60728911E-02 0.16000000E+04 0.99999974 13.35927909 1.53577930 0.43625372E-02 0.16500000E+04 0.99999973 13.23279826 1.53578308 0.31518931E-02 0.17000000E+04 0.99999972 13.10628483 1.53579103 0.22914455E-02 0.17500000E+04 0.99999971 12.97973520 1.53579898 0.16769331E-02 0.18000000E+04 0.99999970 12.85314533 1.53581257 0.12356814E-02 0.18500000E+04 0.99999970 12.72651081 1.53583688 0.91698056E-03 0.19000000E+04 0.99999969 12.59982686 1.53586729 0.68536712E-03 0.19500000E+04 0.99999968 12.47308838 1.53589179 0.51596038E-03 0.20000000E+04 0.99999967 12.34628997 1.53591488 0.39123508E-03 0.20500000E+04 0.99999966 12.21942605 1.53594604 0.29879180E-03 0.21000000E+04 0.99999965 12.09249083 1.53597817 0.22981311E-03 0.21500000E+04 0.99999965 11.96547841 1.53601512 0.17799620E-03 0.22000000E+04 0.99999964 11.83838274 1.53606151 0.13881056E-03 0.22500000E+04 0.99999963 11.71119773 1.53611509 0.10898061E-03 0.23000000E+04 0.99999962 11.58391720 1.53616378 0.86124811E-04 0.23500000E+04 0.99999961 11.45653491 1.53620693 0.68500116E-04 0.24000000E+04 0.99999961 11.32904455 1.53625652 0.54823673E-04 0.24500000E+04 0.99999960 11.20143981 1.53630925 0.44145479E-04 0.25000000E+04 0.99999959 11.07371430 1.53636247 0.35757828E-04 0.25500000E+04 0.99999958 10.94586164 1.53642448 0.29130430E-04 0.26000000E+04 0.99999957 10.81787546 1.53649231 0.23863642E-04 0.26500000E+04 0.99999956 10.68974944 1.53655751 0.19654317E-04 0.27000000E+04 0.99999956 10.56147737 1.53661465 0.16272132E-04 0.27500000E+04 0.99999955 10.43305327 1.53667547 0.13539929E-04 0.28000000E+04 0.99999954 10.30447139 1.53674328 0.11321441E-04 0.28500000E+04 0.99999953 10.17572646 1.53681073 0.95111178E-05 0.29000000E+04 0.99999952 10.04681371 1.53688578 0.80267597E-05 0.29500000E+04 0.99999952 9.91772915 1.53696931 0.68037974E-05 0.30000000E+04 0.99999951 9.78846970 1.53705297 0.57920509E-05 0.30500000E+04 0.99999950 9.65903346 1.53713134 0.49512365E-05 0.31000000E+04 0.99999949 9.52941997 1.53721295 0.42495107E-05 0.31500000E+04 0.99999948 9.39963052 1.53730728 0.36614424E-05 0.32000000E+04 0.99999947 9.26966846 1.53740845 0.31666487E-05 0.32500000E+04 0.99999947 9.13953961 1.53751930 0.27487271E-05 0.33000000E+04 0.99999946 9.00925263 1.53764836 0.23944052E-05 0.33500000E+04 0.99999945 8.87881951 1.53778790 0.20928770E-05 0.34000000E+04 0.99999944 8.74825602 1.53793510 0.18353109E-05 0.34500000E+04 0.99999943 8.61758223 1.53809643 0.16144919E-05 0.35000000E+04 0.99999942 8.48682309 1.53828747 0.14245362E-05 0.35500000E+04 0.99999941 8.35600901 1.53850840 0.12603970E-05 0.36000000E+04 0.99999941 8.22517644 1.53875992 0.11185729E-05 0.36500000E+04 0.99999940 8.09436852 1.53905531 0.99547374E-06 0.37000000E+04 0.99999939 7.96363576 1.53939542 0.88828446E-06 0.37500000E+04 0.99999938 7.83303666 1.53977740 0.79465129E-06 0.38000000E+04 0.99999937 7.70263834 1.54021155 0.71262578E-06 0.38500000E+04 0.99999936 7.57251726 1.54071435 0.64059334E-06 0.39000000E+04 0.99999935 7.44275972 1.54129636 0.57719788E-06 0.39500000E+04 0.99999934 7.31346247 1.54195614 0.52107989E-06 0.40000000E+04 0.99999932 7.18473318 1.54270545 0.47166858E-06 0.40500000E+04 0.99999930 7.05669081 1.54355185 0.42790066E-06 0.41000000E+04 0.99999927 6.92946591 1.54448875 0.38902623E-06 0.41500000E+04 0.99999924 6.80320081 1.54552025 0.35437554E-06 0.42000000E+04 0.99999918 6.67804962 1.54665586 0.32336934E-06 0.42500000E+04 0.99999910 6.55417811 1.54790040 0.29554721E-06 0.43000000E+04 0.99999898 6.43176343 1.54924453 0.27057344E-06 0.43500000E+04 0.99999881 6.31099365 1.55067975 0.24800092E-06 0.44000000E+04 0.99999857 6.19206713 1.55220206 0.22798374E-06 0.44500000E+04 0.99999823 6.07519177 1.55379207 0.21004522E-06 0.45000000E+04 0.99999777 5.96058403 1.55542983 0.19388619E-06 0.45500000E+04 0.99999715 5.84846783 1.55710652 0.17923172E-06 0.46000000E+04 0.99999632 5.73907325 1.55880931 0.16587405E-06 0.46500000E+04 0.99999525 5.63263508 1.56051852 0.15367773E-06 0.47000000E+04 0.99999389 5.52939114 1.56221040 0.14255219E-06 0.47500000E+04 0.99999217 5.42958051 1.56387113 0.13241901E-06 0.48000000E+04 0.99999005 5.33344156 1.56548390 0.12319689E-06 0.48500000E+04 0.99998745 5.24120990 1.56702859 0.11480419E-06 0.49000000E+04 0.99998433 5.15311613 1.56849636 0.10716370E-06 0.49500000E+04 0.99998061 5.06938371 1.56988223 0.99993840E-07 0.50000000E+04 0.99997625 4.99022675 1.57117505 0.93637044E-07 0.50500000E+04 0.99997119 4.91584792 1.57235939 0.87814660E-07 0.51000000E+04 0.99996539 4.84643657 1.57342176 0.82453866E-07 0.51500000E+04 0.99995881 4.78216700 1.57435160 0.77489775E-07 0.52000000E+04 0.99995143 4.72319711 1.57513390 0.72872345E-07 0.52500000E+04 0.99994325 4.66966713 1.57576059 0.68569578E-07 0.53000000E+04 0.99993429 4.62169870 1.57623293 0.64554039E-07 0.53500000E+04 0.99992459 4.57939418 1.57655299 0.60812514E-07 0.54000000E+04 0.99991420 4.54283614 1.57672249 0.57332281E-07 0.54500000E+04 0.99990321 4.51208711 1.57674472 0.54089593E-07 0.55000000E+04 0.99989172 4.48718961 1.57662572 0.51089038E-07 0.55500000E+04 0.99987986 4.46816633 1.57636916 0.48123127E-07 0.56000000E+04 0.99986776 4.45502066 1.57597818 0.45534127E-07 0.56500000E+04 0.99985557 4.44773729 1.57546178 0.43168893E-07 0.57000000E+04 0.99984343 4.44628310 1.57483064 0.40983717E-07 0.57500000E+04 0.99983149 4.45060807 1.57409474 0.38915287E-07 0.58000000E+04 0.99981987 4.46064640 1.57326471 0.37048674E-07 0.58500000E+04 0.99980870 4.47631765 1.57235163 0.35310925E-07 0.59000000E+04 0.99979806 4.49752791 1.57136519 0.33574987E-07 0.59500000E+04 0.99978804 4.52417107 1.57031211 0.32045016E-07 0.60000000E+04 0.99977867 4.55613000 1.56920102 0.30672181E-07 0.60500000E+04 0.99976998 4.59327774 1.56804244 0.29132322E-07 0.61000000E+04 0.99976197 4.63547864 1.56684651 0.27720699E-07 0.61500000E+04 0.99975463 4.68258947 1.56562350 0.26619878E-07 0.62000000E+04 0.99974792 4.73446046 1.56438371 0.25417234E-07 0.62500000E+04 0.99974181 4.79093634 1.56313585 0.24102672E-07 0.63000000E+04 0.99973626 4.85185729 1.56188622 0.23018055E-07 0.63500000E+04 0.99973121 4.91705996 1.56064033 0.21797515E-07 0.64000000E+04 0.99972662 4.98637833 1.55940454 0.21343838E-07 0.64500000E+04 0.99972244 5.05964464 1.55818444 0.20957405E-07 0.65000000E+04 0.99971861 5.13669029 1.55698466 0.18998092E-07 0.65500000E+04 0.99971510 5.21734662 1.55580899 0.18451042E-07 0.66000000E+04 0.99971183 5.30144574 1.55466000 0.21404104E-07 0.66500000E+04 0.99970876 5.38882118 1.55353940 0.22321279E-07 0.67000000E+04 0.99970583 5.47930851 1.55244945 0.20172806E-07 ==> ZAnalysis on specular channel fixed at Z = 0.16800000E+02 0.67500000E+04 0.99970294 5.57274581 1.55139420 0.24598345E-07 0.68000000E+04 0.99970000 5.66897417 1.55037818 0.37035152E-07 0.68500000E+04 0.99969685 5.76783794 1.54940410 0.45618291E-07 0.69000000E+04 0.99969331 5.86918501 1.54847216 0.48866970E-07 0.69500000E+04 0.99968912 5.97286704 1.54758001 0.61725455E-07 0.70000000E+04 0.99968392 6.07873946 1.54672420 0.89931210E-07 0.70500000E+04 0.99967725 6.18666147 1.54590280 0.11969594E-06 0.71000000E+04 0.99966849 6.29649590 1.54511727 0.14051975E-06 0.71500000E+04 0.99965684 6.40810895 1.54437132 0.16286487E-06 0.72000000E+04 0.99964124 6.52136983 1.54366765 0.20350762E-06 0.72500000E+04 0.99962036 6.63615040 1.54300559 0.26122645E-06 0.73000000E+04 0.99959250 6.75232474 1.54238091 0.31797148E-06 0.73500000E+04 0.99955560 6.86976872 1.54178767 0.36370185E-06 0.74000000E+04 0.99950710 6.98835962 1.54122172 0.41112625E-06 0.74500000E+04 0.99944397 7.10797578 1.54068326 0.48231931E-06 0.75000000E+04 0.99936265 7.22849638 1.54017617 0.58493604E-06 0.75500000E+04 0.99925899 7.34980127 1.53970438 0.70569171E-06 0.76000000E+04 0.99912831 7.47177101 1.53926809 0.83008749E-06 0.76500000E+04 0.99896534 7.59428697 1.53886298 0.96949292E-06 0.77000000E+04 0.99876428 7.71723161 1.53848237 0.11593397E-05 0.77500000E+04 0.99851880 7.84048881 1.53812105 0.14158865E-05 0.78000000E+04 0.99822210 7.96394424 1.53777843 0.16983261E-05 0.78500000E+04 0.99786697 8.08748579 1.53745846 0.19363350E-05 0.79000000E+04 0.99744580 8.21100399 1.53716588 0.21033034E-05 0.79500000E+04 0.99695064 8.33439235 1.53690203 0.22473061E-05 0.80000000E+04 0.99637330 8.45754786 1.53666321 0.24659919E-05 0.80500000E+04 0.99570535 8.58037128 1.53644302 0.29427281E-05 0.81000000E+04 0.99493823 8.70276765 1.53623634 0.41465274E-05 0.81500000E+04 0.99406330 8.82464667 1.53604262 0.71192584E-05 0.82000000E+04 0.99307196 8.94592312 1.53586605 0.13676833E-04 0.82500000E+04 0.99195565 9.06651721 1.53571186 0.26518216E-04 0.83000000E+04 0.99070600 9.18635485 1.53558172 0.49464599E-04 0.83500000E+04 0.98931484 9.30536792 1.53547175 0.87985718E-04 0.84000000E+04 0.98777430 9.42349433 1.53537467 0.14983446E-03 0.84500000E+04 0.98607683 9.54067824 1.53528445 0.24540347E-03 0.85000000E+04 0.98421534 9.65687021 1.53519990 0.38764650E-03 0.85500000E+04 0.98218327 9.77202759 1.53512519 0.59188887E-03 0.86000000E+04 0.97997473 9.88611510 1.53506637 0.87597317E-03 0.86500000E+04 0.97758477 9.99910568 1.53502643 0.12606976E-02 0.87000000E+04 0.97500952 10.11098154 1.53500264 0.17699729E-02 0.87500000E+04 0.97224654 10.22173547 1.53498811 0.24301340E-02 0.88000000E+04 0.96929507 10.33137212 1.53497654 0.32684199E-02 0.88500000E+04 0.96615632 10.43990926 1.53496611 0.43113391E-02 0.89000000E+04 0.96283370 10.54737879 1.53496024 0.55837104E-02 0.89500000E+04 0.95933301 10.65382733 1.53496454 0.71083878E-02 0.90000000E+04 0.95566249 10.75931626 1.53498192 0.89060427E-02 0.90500000E+04 0.95183285 10.86392120 1.53500969 0.10994404E-01 0.91000000E+04 0.94785706 10.96773075 1.53504080 0.13386823E-01 0.91500000E+04 0.94375016 11.07084473 1.53506854 0.16090799E-01 0.92000000E+04 0.93952889 11.17337189 1.53509108 0.19107314E-01 0.92500000E+04 0.93521133 11.27542746 1.53511237 0.22431128E-01 0.93000000E+04 0.93081647 11.37713046 1.53513921 0.26051652E-01 0.93500000E+04 0.92636382 11.47860125 1.53517617 0.29953874E-01 0.94000000E+04 0.92187302 11.57995908 1.53522194 0.34118705E-01 0.94500000E+04 0.91736347 11.68131999 1.53527003 0.38522582E-01 0.95000000E+04 0.91285398 11.78279482 1.53531307 0.43136858E-01 0.95500000E+04 0.90836249 11.88448744 1.53534799 0.47927380E-01 0.96000000E+04 0.90390568 11.98649310 1.53537770 0.52854712E-01 0.96500000E+04 0.89949880 12.08889701 1.53540858 0.57875337E-01 0.97000000E+04 0.89515530 12.19177303 1.53544570 0.62943370E-01 0.97500000E+04 0.89088673 12.29518264 1.53548884 0.68012389E-01 0.98000000E+04 0.88670248 12.39917418 1.53553247 0.73037252E-01 0.98500000E+04 0.88260967 12.50378222 1.53556964 0.77975373E-01 0.99000000E+04 0.87861304 12.60902722 1.53559728 0.82787346E-01 0.99500000E+04 0.87471478 12.71491518 1.53561841 0.87437294E-01 0.10000000E+05 0.87091447 12.82143751 1.53563979 0.91893016E-01 0.10050000E+05 0.86720899 12.92857089 1.53566709 0.96126310E-01 0.10100000E+05 0.86359241 13.03627742 1.53570067 0.10011366E+00 0.10150000E+05 0.86005609 13.14450495 1.53573486 0.10383672E+00 0.10200000E+05 0.85658876 13.25318781 1.53576191 0.10728235E+00 0.10250000E+05 0.85317668 13.36224784 1.53577754 0.11044197E+00 0.10300000E+05 0.84980403 13.47159588 1.53578422 0.11331048E+00 0.10350000E+05 0.84645318 13.58113342 1.53578922 0.11588496E+00 0.10400000E+05 0.84310512 13.69075439 1.53579965 0.11816384E+00 0.10450000E+05 0.83973985 13.80034694 1.53581781 0.12014664E+00 0.10500000E+05 0.83633666 13.90979498 1.53583960 0.12183417E+00 0.10550000E+05 0.83287444 14.01897967 1.53585760 0.12322919E+00 0.10600000E+05 0.82933187 14.12778043 1.53586654 0.12433703E+00 0.10650000E+05 0.82568761 14.23607599 1.53586712 0.12516570E+00 0.10700000E+05 0.82192037 14.34374512 1.53586495 0.12572575E+00 0.10750000E+05 0.81800912 14.45066739 1.53586605 0.12602960E+00 0.10800000E+05 0.81393313 14.55672390 1.53587261 0.12609078E+00 0.10850000E+05 0.80967226 14.66179799 1.53588146 0.12592327E+00 0.10900000E+05 0.80520707 14.76577609 1.53588668 0.12554092E+00 0.10950000E+05 0.80051906 14.86854845 1.53588465 0.12495715E+00 0.11000000E+05 0.79559095 14.97000997 1.53587749 0.12418505E+00 0.11050000E+05 0.79040680 15.07006097 1.53587169 0.12323751E+00 0.11100000E+05 0.78495235 15.16860792 1.53587289 0.12212748E+00 0.11150000E+05 0.77921506 15.26556412 1.53588154 0.12086793E+00 0.11200000E+05 0.77318437 15.36085031 1.53589195 0.11947165E+00 0.11250000E+05 0.76685175 15.45439527 1.53589581 0.11795097E+00 0.11300000E+05 0.76021081 15.54613624 1.53588830 0.11631772E+00 0.11350000E+05 0.75325733 15.63601935 1.53587241 0.11458345E+00 0.11400000E+05 0.74598930 15.72399984 1.53585737 0.11275966E+00 0.11450000E+05 0.73840692 15.81004218 1.53585219 0.11085785E+00 0.11500000E+05 0.73051258 15.89412007 1.53585931 0.10888900E+00 0.11550000E+05 0.72231078 15.97621616 1.53587295 0.10686307E+00 0.11600000E+05 0.71380810 16.05632174 1.53588241 0.10478879E+00 0.11650000E+05 0.70501305 16.13443618 1.53587933 0.10267390E+00 0.11700000E+05 0.69593599 16.21056634 1.53586379 0.10052574E+00 0.11750000E+05 0.68658894 16.28472578 1.53584438 0.98351618E-01 0.11800000E+05 0.67698541 16.35693406 1.53583219 0.96158686E-01 0.11850000E+05 0.66714020 16.42721589 1.53583327 0.93953607E-01 0.11900000E+05 0.65706921 16.49560041 1.53584527 0.91742249E-01 0.11950000E+05 0.64678922 16.56212043 1.53585918 0.89529805E-01 0.12000000E+05 0.63631775 16.62681180 1.53586508 0.87321185E-01 0.12050000E+05 0.62567281 16.68971283 1.53585888 0.85121302E-01 0.12100000E+05 0.61487279 16.75086381 1.53584443 0.82935002E-01 0.12150000E+05 0.60393634 16.81030660 1.53582977 0.80766680E-01 0.12200000E+05 0.59288222 16.86808427 1.53582113 0.78619893E-01 0.12250000E+05 0.58172917 16.92424090 1.53581984 0.76497279E-01 0.12300000E+05 0.57049587 16.97882129 1.53582295 0.74400866E-01 0.12350000E+05 0.55920075 17.03187076 1.53582617 0.72332502E-01 0.12400000E+05 0.54786194 17.08343496 1.53582774 0.70294148E-01 0.12450000E+05 0.53649716 17.13355965 1.53582951 0.68287834E-01 0.12500000E+05 0.52512362 17.18229043 1.53583336 0.66315412E-01 0.12550000E+05 0.51375790 17.22967255 1.53583729 0.64378329E-01 0.12600000E+05 0.50241593 17.27575062 1.53583577 0.62477605E-01 0.12650000E+05 0.49111289 17.32056840 1.53582435 0.60613967E-01 0.12700000E+05 0.47986317 17.36416855 1.53580416 0.58788046E-01 0.12750000E+05 0.46868037 17.40659254 1.53578377 0.57000486E-01 0.12800000E+05 0.45757725 17.44788048 1.53577622 0.55251913E-01 0.12850000E+05 0.44656574 17.48807117 1.53578990 0.53542820E-01 0.12900000E+05 0.43565697 17.52720213 1.53582027 0.51873487E-01 0.12950000E+05 0.42486127 17.56530961 1.53585014 0.50243974E-01 0.13000000E+05 0.41418817 17.60242875 1.53585975 0.48654188E-01 0.13050000E+05 0.40364641 17.63859358 1.53583908 0.47103914E-01 0.13100000E+05 0.39324398 17.67383710 1.53579526 0.45592829E-01 0.13150000E+05 0.38298815 17.70819129 1.53575127 0.44120536E-01 0.13200000E+05 0.37288542 17.74168709 1.53573329 0.42686603E-01 0.13250000E+05 0.36294161 17.77435440 1.53575331 0.41290633E-01 0.13300000E+05 0.35316188 17.80622208 1.53580076 0.39932288E-01 0.13350000E+05 0.34355070 17.83731788 1.53584877 0.38611248E-01 0.13400000E+05 0.33411194 17.86766850 1.53586964 0.37327086E-01 0.13450000E+05 0.32484887 17.89729956 1.53585010 0.36079171E-01 0.13500000E+05 0.31576422 17.92623570 1.53579992 0.34866677E-01 0.13550000E+05 0.30686017 17.95450055 1.53574723 0.33688719E-01 0.13600000E+05 0.29813841 17.98211687 1.53572074 0.32544532E-01 0.13650000E+05 0.28960019 18.00910656 1.53573283 0.31433569E-01 0.13700000E+05 0.28124630 18.03549075 1.53577461 0.30355459E-01 0.13750000E+05 0.27307714 18.06128978 1.53582251 0.29309842E-01 0.13800000E+05 0.26509273 18.08652324 1.53585081 0.28296199E-01 0.13850000E+05 0.25729272 18.11121000 1.53584550 0.27313779E-01 0.13900000E+05 0.24967646 18.13536815 1.53581236 0.26361688E-01 0.13950000E+05 0.24224296 18.15901505 1.53577101 0.25439042E-01 0.14000000E+05 0.23499098 18.18216728 1.53574149 0.24545107E-01 0.14050000E+05 0.22791901 18.20484069 1.53573530 0.23679315E-01 0.14100000E+05 0.22102530 18.22705038 1.53575237 0.22841170E-01 0.14150000E+05 0.21430789 18.24881072 1.53578185 0.22030115E-01 0.14200000E+05 0.20776465 18.27013537 1.53580816 0.21245465E-01 0.14250000E+05 0.20139324 18.29103734 1.53582085 0.20486431E-01 0.14300000E+05 0.19519120 18.31152897 1.53581814 0.19752225E-01 0.14350000E+05 0.18915593 18.33162200 1.53580284 0.19042134E-01 0.14400000E+05 0.18328471 18.35132760 1.53578038 0.18355546E-01 0.14450000E+05 0.17757471 18.37065642 1.53575895 0.17691892E-01 0.14500000E+05 0.17202304 18.38961860 1.53574621 0.17050576E-01 0.14550000E+05 0.16662673 18.40822384 1.53574569 0.16430939E-01 0.14600000E+05 0.16138274 18.42648142 1.53575831 0.15832280E-01 0.14650000E+05 0.15628800 18.44440018 1.53578255 0.15253910E-01 0.14700000E+05 0.15133941 18.46198861 1.53580970 0.14695208E-01 0.14750000E+05 0.14653382 18.47925480 1.53582547 0.14155633E-01 0.14800000E+05 0.14186809 18.49620648 1.53581987 0.13634702E-01 0.14850000E+05 0.13733904 18.51285103 1.53579313 0.13131950E-01 0.14900000E+05 0.13294352 18.52919545 1.53575496 0.12646888E-01 0.14950000E+05 0.12867837 18.54524642 1.53572321 0.12178994E-01 0.15000000E+05 0.12454044 18.56101029 1.53571784 0.11727727E-01 0.15050000E+05 0.12052660 18.57649308 1.53574575 0.11292543E-01 0.15100000E+05 0.11663376 18.59170049 1.53579260 0.10872906E-01 0.15150000E+05 0.11285883 18.60663792 1.53583287 0.10468296E-01 0.15200000E+05 0.10919877 18.62131048 1.53584483 0.10078209E-01 0.15250000E+05 0.10565057 18.63572298 1.53581963 0.97021759E-02 0.15300000E+05 0.10221129 18.64988003 1.53576808 0.93397756E-02 0.15350000E+05 0.09887798 18.66378598 1.53571949 0.89906151E-02 0.15400000E+05 0.09564779 18.67744507 1.53570266 0.86542851E-02 0.15450000E+05 0.09251790 18.69086136 1.53572507 0.83303335E-02 0.15500000E+05 0.08948554 18.70403882 1.53577244 0.80182781E-02 0.15550000E+05 0.08654800 18.71698131 1.53582025 0.77176480E-02 0.15600000E+05 0.08370261 18.72969259 1.53584337 0.74280181E-02 0.15650000E+05 0.08094678 18.74217631 1.53582844 0.71490123E-02 0.15700000E+05 0.07827794 18.75443603 1.53578555 0.68802869E-02 0.15750000E+05 0.07569360 18.76647521 1.53574054 0.66215078E-02 0.15800000E+05 0.07319133 18.77829723 1.53571468 0.63723300E-02 0.15850000E+05 0.07076873 18.78990538 1.53571698 0.61323925E-02 0.15900000E+05 0.06842348 18.80130289 1.53574644 0.59013296E-02 0.15950000E+05 0.06615331 18.81249291 1.53578926 0.56787973E-02 0.16000000E+05 0.06395599 18.82347853 1.53582225 0.54645000E-02 0.16050000E+05 0.06182937 18.83426278 1.53582956 0.52581937E-02 0.16100000E+05 0.05977132 18.84484864 1.53581112 0.50596593E-02 0.16150000E+05 0.05777980 18.85523904 1.53577501 0.48686598E-02 0.16200000E+05 0.05585280 18.86543690 1.53573497 0.46849124E-02 0.16250000E+05 0.05398836 18.87544511 1.53571197 0.45081030E-02 0.16300000E+05 0.05218459 18.88526653 1.53572077 0.43379316E-02 0.16350000E+05 0.05043964 18.89490400 1.53575576 0.41741514E-02 0.16400000E+05 0.04875170 18.90436036 1.53579828 0.40165681E-02 0.16450000E+05 0.04711902 18.91363841 1.53582971 0.38650063E-02 0.16500000E+05 0.04553990 18.92274090 1.53583358 0.37192762E-02 0.16550000E+05 0.04401267 18.93167059 1.53580288 0.35791624E-02 0.16600000E+05 0.04253573 18.94043017 1.53575324 0.34444309E-02 0.16650000E+05 0.04110750 18.94902232 1.53571415 0.33148439E-02 0.16700000E+05 0.03972646 18.95744967 1.53570525 0.31901768E-02 0.16750000E+05 0.03839112 18.96571483 1.53572947 0.30702362E-02 0.16800000E+05 0.03710006 18.97382040 1.53577743 0.29548633E-02 0.16850000E+05 0.03585185 18.98176891 1.53582538 0.28439136E-02 0.16900000E+05 0.03464516 18.98956291 1.53584327 0.27372290E-02 0.16950000E+05 0.03347865 18.99720489 1.53582017 0.26346286E-02 0.17000000E+05 0.03235105 19.00469729 1.53577219 0.25359290E-02 0.17050000E+05 0.03126111 19.01204253 1.53572436 0.24409686E-02 0.17100000E+05 0.03020761 19.01924298 1.53569918 0.23496119E-02 0.17150000E+05 0.02918940 19.02630100 1.53571295 0.22617359E-02 0.17200000E+05 0.02820532 19.03321891 1.53576127 0.21772168E-02 0.17250000E+05 0.02725428 19.03999903 1.53581416 0.20959281E-02 0.17300000E+05 0.02633521 19.04664363 1.53584091 0.20177426E-02 0.17350000E+05 0.02544706 19.05315495 1.53583139 0.19425291E-02 0.17400000E+05 0.02458882 19.05953521 1.53579101 0.18701535E-02 0.17450000E+05 0.02375952 19.06578657 1.53573735 0.18004919E-02 0.17500000E+05 0.02295821 19.07191118 1.53570133 0.17334477E-02 0.17550000E+05 0.02218397 19.07791112 1.53570675 0.16689532E-02 0.17600000E+05 0.02143590 19.08378848 1.53574739 0.16069479E-02 0.17650000E+05 0.02071315 19.08954531 1.53579757 0.15473514E-02 0.17700000E+05 0.02001488 19.09518360 1.53583413 0.14900536E-02 0.17750000E+05 0.01934028 19.10070530 1.53583875 0.14349316E-02 0.17800000E+05 0.01868856 19.10611233 1.53580431 0.13818769E-02 0.17850000E+05 0.01805895 19.11140651 1.53575063 0.13308112E-02 0.17900000E+05 0.01745072 19.11658966 1.53571242 0.12816812E-02 0.17950000E+05 0.01686317 19.12166354 1.53570816 0.12344403E-02 0.18000000E+05 0.01629558 19.12662990 1.53573491 0.11890323E-02 0.18050000E+05 0.01574730 19.13149046 1.53578114 0.11453881E-02 0.18100000E+05 0.01521768 19.13624691 1.53582477 0.11034300E-02 0.18150000E+05 0.01470609 19.14090088 1.53583775 0.10630800E-02 0.18200000E+05 0.01421193 19.14545396 1.53581288 0.10242632E-02 0.18250000E+05 0.01373459 19.14990771 1.53576974 0.98691049E-03 0.18300000E+05 0.01327353 19.15426366 1.53573068 0.95096061E-03 0.18350000E+05 0.01282818 19.15852330 1.53571085 0.91636360E-03 0.18400000E+05 0.01239801 19.16268814 1.53572310 0.88308027E-03 0.18450000E+05 0.01198252 19.16675961 1.53576532 0.85107565E-03 0.18500000E+05 0.01158119 19.17073916 1.53581109 0.82030869E-03 0.18550000E+05 0.01119356 19.17462820 1.53583379 0.79072615E-03 0.18600000E+05 0.01081915 19.17842810 1.53582663 0.76226562E-03 0.18650000E+05 0.01045751 19.18214023 1.53579337 0.73486597E-03 0.18700000E+05 0.01010822 19.18576591 1.53574557 0.70847745E-03 0.18750000E+05 0.00977084 19.18930647 1.53571047 0.68306490E-03 0.18800000E+05 0.00944497 19.19276319 1.53571314 0.65860257E-03 0.18850000E+05 0.00913022 19.19613734 1.53575011 0.63506597E-03 0.18900000E+05 0.00882621 19.19943017 1.53579839 0.61242572E-03 0.18950000E+05 0.00853257 19.20264291 1.53583653 0.59064632E-03 0.19000000E+05 0.00824894 19.20577676 1.53584439 0.56968774E-03 0.19050000E+05 0.00797498 19.20883290 1.53581046 0.54950782E-03 0.19100000E+05 0.00771036 19.21181249 1.53575305 0.53006490E-03 0.19150000E+05 0.00745476 19.21471664 1.53571036 0.51132176E-03 0.19200000E+05 0.00720787 19.21754644 1.53570547 0.49324988E-03 0.19250000E+05 0.00696939 19.22030292 1.53573781 0.47583221E-03 0.19300000E+05 0.00673903 19.22298706 1.53579424 0.45906045E-03 0.19350000E+05 0.00651651 19.22559979 1.53584588 0.44292765E-03 0.19400000E+05 0.00630156 19.22814199 1.53585680 0.42741913E-03 0.19450000E+05 0.00609392 19.23061453 1.53581839 0.41250737E-03 0.19500000E+05 0.00589334 19.23301828 1.53575842 0.39815374E-03 0.19550000E+05 0.00569958 19.23535410 1.53571124 0.38431669E-03 0.19600000E+05 0.00551239 19.23762285 1.53569944 0.37096168E-03 0.19650000E+05 0.00533156 19.23982541 1.53573375 0.35806782E-03 0.19700000E+05 0.00515686 19.24196262 1.53579936 0.34562783E-03 0.19750000E+05 0.00498809 19.24403534 1.53585322 0.33364174E-03 0.19800000E+05 0.00482504 19.24604441 1.53586056 0.32210812E-03 0.19850000E+05 0.00466751 19.24799063 1.53582288 0.31101772E-03 0.19900000E+05 0.00451531 19.24987481 1.53576371 0.30035187E-03 0.19950000E+05 0.00436826 19.25169772 1.53571224 0.29008588E-03 0.20000000E+05 0.00422619 19.25346012 1.53570007 0.28019426E-03 warning: ndused not equal to ndatus ************************************************************************ info from reading or writing asymptotic info ************************************************************************ # timesteps for which bk coefs available is: 400 # data used, ndused = 396 effective prop.time, spectral resolution (mev) = 19800.0000 0.4317532E+01 meaningful results in kin energy range (ev) 0.004318 1.709743 results will be obtained for nen95 energies,nen95 = 93 ************************************************************************ info from gtaife ************************************************************************ ************************************************************************ info from probaf ************************************************************************ # of data skipped in between data in next printout = 0 idat ekin(ev) preact phase 1 0.1511136 -0.001556 2.92832 2 0.1554312 -0.019644 2.38491 3 0.1597487 -0.024571 1.86438 4 0.1640662 -0.015860 1.35744 5 0.1683837 -0.000016 0.85550 6 0.1727013 0.013236 0.35485 7 0.1770188 0.016493 -0.14073 8 0.1813363 0.008878 -0.62218 9 0.1856539 -0.003624 -1.08237 10 0.1899714 -0.012133 -1.52190 11 0.1942889 -0.010891 -1.94834 12 0.1986065 -0.001416 -2.37084 13 0.2029240 0.008485 -2.79353 14 0.2072415 0.010708 3.07117 15 0.2115591 0.003628 2.66593 16 0.2158766 -0.006147 2.27854 17 0.2201941 -0.009416 1.90475 18 0.2245117 -0.003109 1.53556 19 0.2288292 0.006266 1.16552 20 0.2331467 0.008826 0.79808 21 0.2374643 0.001767 0.44190 22 0.2417818 -0.007094 0.10089 23 0.2460993 -0.007660 -0.23023 24 0.2504169 0.000711 -0.56002 25 0.2547344 0.007962 -0.89100 26 0.2590519 0.005226 -1.21667 27 0.2633695 -0.003970 -1.52970 28 0.2676870 -0.007763 -1.83132 29 0.2720045 -0.001197 -2.12975 30 0.2763221 0.006935 -2.43004 31 0.2806396 0.005617 -2.72766 32 0.2849571 -0.003259 -3.01464 33 0.2892746 -0.007242 2.99249 34 0.2935922 -0.000798 2.71956 35 0.2979097 0.006599 2.44439 36 0.3022272 0.004074 2.17155 37 0.3065448 -0.004571 1.90885 38 0.3108623 -0.006361 1.65562 39 0.3151798 0.001293 1.40366 40 0.3194974 0.006540 1.14916 41 0.3238149 0.001327 0.89850 42 0.3281324 -0.005996 0.65831 43 0.3324500 -0.003805 0.42490 44 0.3367675 0.004271 0.18992 45 0.3410850 0.005159 -0.04656 46 0.3454026 -0.002427 -0.27605 47 0.3497201 -0.005862 -0.49568 48 0.3540376 0.000500 -0.71310 49 0.3583552 0.005858 -0.93399 50 0.3626727 0.001114 -1.15241 51 0.3669902 -0.005602 -1.36083 52 0.3713078 -0.002746 -1.56329 53 0.3756253 0.004657 -1.76873 54 0.3799428 0.003579 -1.97543 55 0.3842604 -0.004120 -2.17370 56 0.3885779 -0.004748 -2.36334 57 0.3928954 0.002818 -2.55425 58 0.3972129 0.004817 -2.74881 59 0.4015305 -0.002485 -2.93704 60 0.4058480 -0.005589 -3.11501 61 0.4101655 0.001468 2.99066 62 0.4144831 0.005568 2.80795 63 0.4188006 -0.001148 2.62971 64 0.4231181 -0.005992 2.46290 65 0.4274357 0.000397 2.29804 66 0.4317532 0.005680 2.12685 67 0.4360707 -0.000574 1.95882 68 0.4403883 -0.006114 1.80328 69 0.4447058 0.000193 1.65048 70 0.4490233 0.005899 1.49001 71 0.4533409 -0.000499 1.33213 72 0.4576584 -0.006132 1.18822 73 0.4619759 0.000454 1.04721 74 0.4662935 0.005771 0.89684 75 0.4706110 -0.001084 0.74939 76 0.4749285 -0.005804 0.61780 77 0.4792461 0.001471 0.48812 78 0.4835636 0.005529 0.34681 79 0.4878811 -0.002013 0.21019 80 0.4921987 -0.005192 0.09194 81 0.4965162 0.002416 -0.02688 82 0.5008337 0.004400 -0.15981 83 0.5051512 -0.003254 -0.28414 84 0.5094688 -0.004060 -0.38773 85 0.5137863 0.003393 -0.49703 86 0.5181038 0.003097 -0.62276 87 0.5224214 -0.003751 -0.73300 88 0.5267389 -0.002264 -0.82116 89 0.5310564 0.003962 -0.92333 90 0.5353740 0.001719 -1.04191 91 0.5396915 -0.003405 -1.13436 92 0.5440090 -0.000229 -1.20707 93 0.5483266 0.004295 -1.30617 ******************************************************************************** PRINTING SCATTERING AND REACTION PROBABILITIES ******************************************************************************** etrans(icomin)= 0.151114 etrans(icomax)= 0.548327 etrans= 0.150000 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.41843953D+01 trans energy = 0.20714286D+00 trans energy in z = 0.20714286D+00 total momentum = 0.74792309D+01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9892949E+00 0.3919038E-02 0.4916700E+00 1 0.4755419E-04 0.7068945E-02 0.8892177E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.1506653E-03 0 31 2 -2 0.4425798E-05 0 37 2 -1 0.4300222E-04 0 44 2 0 0.6251577E-03 0 50 2 1 0.4300222E-04 0 56 2 2 0.4425798E-05 0 21 4 -4 0.8189349E-06 0 26 4 -3 0.7897527E-05 0 32 4 -2 0.6512314E-04 0 38 4 -1 0.2352287E-03 0 45 4 0 0.1621800E-02 0 51 4 1 0.2352287E-03 0 57 4 2 0.6512314E-04 0 62 4 3 0.7897527E-05 0 67 4 4 0.8189344E-06 0 13 6 -6 0.7533501E-07 0 17 6 -5 0.8139529E-06 0 22 6 -4 0.6729881E-05 0 27 6 -3 0.3664266E-04 0 33 6 -2 0.2675224E-03 0 39 6 -1 0.4705575E-03 0 46 6 0 0.9070760E-02 0 52 6 1 0.4705574E-03 0 58 6 2 0.2675224E-03 0 63 6 3 0.3664266E-04 0 68 6 4 0.6729880E-05 0 72 6 5 0.8139527E-06 0 76 6 6 0.7533511E-07 0 7 8 -8 0.4884030E-09 0 10 8 -7 0.7407642E-08 0 14 8 -6 0.1533944E-06 0 18 8 -5 0.4100006E-06 0 23 8 -4 0.1794769E-04 0 28 8 -3 0.6595027E-04 0 34 8 -2 0.5896112E-02 0 40 8 -1 0.1214624E-02 0 47 8 0 0.9611584E+00 0 53 8 1 0.1214624E-02 0 59 8 2 0.5896112E-02 0 64 8 3 0.6595027E-04 0 69 8 4 0.1794769E-04 0 73 8 5 0.4100006E-06 0 77 8 6 0.1533944E-06 0 80 8 7 0.7407640E-08 0 83 8 8 0.4884034E-09 0 3 10 -10 0.0000000E+00 0 5 10 -9 0.0000000E+00 0 8 10 -8 0.0000000E+00 0 11 10 -7 0.0000000E+00 0 15 10 -6 0.0000000E+00 0 19 10 -5 0.0000000E+00 0 24 10 -4 0.0000000E+00 0 29 10 -3 0.0000000E+00 0 35 10 -2 0.0000000E+00 0 41 10 -1 0.0000000E+00 0 48 10 0 0.0000000E+00 0 54 10 1 0.0000000E+00 0 60 10 2 0.0000000E+00 0 65 10 3 0.0000000E+00 0 70 10 4 0.0000000E+00 0 74 10 5 0.0000000E+00 0 78 10 6 0.0000000E+00 0 81 10 7 0.0000000E+00 0 84 10 8 0.0000000E+00 0 86 10 9 0.0000000E+00 0 88 10 10 0.0000000E+00 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.3472247E-05 1 31 2 -2 0.1939695E-06 1 37 2 -1 0.2315900E-05 1 44 2 0 0.1573594E-04 1 50 2 1 0.2315900E-05 1 56 2 2 0.1939695E-06 1 21 4 -4 0.1785313E-09 1 26 4 -3 0.3662771E-08 1 32 4 -2 0.5887581E-07 1 38 4 -1 0.1262852E-05 1 45 4 0 0.2067512E-04 1 51 4 1 0.1262852E-05 1 57 4 2 0.5887581E-07 1 62 4 3 0.3662772E-08 1 67 4 4 0.1785313E-09 1 13 6 -6 0.0000000E+00 1 17 6 -5 0.0000000E+00 1 22 6 -4 0.0000000E+00 1 27 6 -3 0.0000000E+00 1 33 6 -2 0.0000000E+00 1 39 6 -1 0.0000000E+00 1 46 6 0 0.0000000E+00 1 52 6 1 0.0000000E+00 1 58 6 2 0.0000000E+00 1 63 6 3 0.0000000E+00 1 68 6 4 0.0000000E+00 1 72 6 5 0.0000000E+00 1 76 6 6 0.0000000E+00 1 7 8 -8 0.0000000E+00 1 10 8 -7 0.0000000E+00 1 14 8 -6 0.0000000E+00 1 18 8 -5 0.0000000E+00 1 23 8 -4 0.0000000E+00 1 28 8 -3 0.0000000E+00 1 34 8 -2 0.0000000E+00 1 40 8 -1 0.0000000E+00 1 47 8 0 0.0000000E+00 1 53 8 1 0.0000000E+00 1 59 8 2 0.0000000E+00 1 64 8 3 0.0000000E+00 1 69 8 4 0.0000000E+00 1 73 8 5 0.0000000E+00 1 77 8 6 0.0000000E+00 1 80 8 7 0.0000000E+00 1 83 8 8 0.0000000E+00 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.1879574E-05 1 0.3277194E-04 2 0.7991473E-04 3 0.3304719E-04 4 0.2954965E-05 5 0.5502403E-07 6 0.1825122E-07 7 0.1491463E-07 8 0.7407520E-08 9 0.1254608E-08 v, j, mj = 0 2 -2 0 0.5280101E-15 1 0.6588481E-06 2 0.2331240E-05 3 0.1257027E-05 4 0.1203980E-06 5 0.3104092E-07 6 0.2194723E-07 7 0.3892695E-08 8 0.9417673E-09 9 0.4616652E-09 v, j, mj = 0 2 -1 0 0.9274985E-17 1 0.1764339E-04 2 0.1510411E-04 3 0.8232901E-05 4 0.1927311E-05 5 0.5404816E-07 6 0.2778404E-07 7 0.9750300E-08 8 0.2265503E-08 9 0.6542741E-09 v, j, mj = 0 2 0 0 0.2946701E-04 1 0.2062880E-03 2 0.2913122E-03 3 0.8965493E-04 4 0.8024225E-05 5 0.2894495E-06 6 0.9539502E-07 7 0.1833141E-07 8 0.7402744E-08 9 0.8715206E-09 v, j, mj = 0 2 1 0 0.1369869E-16 1 0.1764339E-04 2 0.1510411E-04 3 0.8232901E-05 4 0.1927311E-05 5 0.5404878E-07 6 0.2778422E-07 7 0.9750339E-08 8 0.2265506E-08 9 0.6542742E-09 v, j, mj = 0 2 2 0 0.6146098E-15 1 0.6588481E-06 2 0.2331240E-05 3 0.1257028E-05 4 0.1203979E-06 5 0.3104100E-07 6 0.2194736E-07 7 0.3892686E-08 8 0.9417713E-09 9 0.4616653E-09 v, j, mj = 0 4 -4 0 0.2477465E-15 1 0.1369998E-08 2 0.4155516E-07 3 0.3551565E-06 4 0.3447575E-06 5 0.6562597E-07 6 0.8129265E-08 7 0.1067356E-08 8 0.7939943E-09 9 0.4791906E-09 v, j, mj = 0 4 -3 0 0.8236250E-09 1 0.1501155E-06 2 0.2332928E-05 3 0.3741537E-05 4 0.1484444E-05 5 0.1603800E-06 6 0.1715054E-07 7 0.7405045E-08 8 0.2011781E-08 9 0.7313989E-09 v, j, mj = 0 4 -2 0 0.4272845E-14 1 0.9790996E-05 2 0.3230005E-04 3 0.1907889E-04 4 0.3702453E-05 5 0.2136638E-06 6 0.2806736E-07 7 0.3651917E-08 8 0.3287396E-08 9 0.2072301E-08 v, j, mj = 0 4 -1 0 0.2694307E-18 1 0.8404484E-04 2 0.9191447E-04 3 0.5082987E-04 4 0.7946670E-05 5 0.4152315E-06 6 0.7023908E-07 7 0.6726896E-08 8 0.6396007E-09 9 0.5405319E-10 v, j, mj = 0 4 0 0 0.2959970E-03 1 0.8326530E-03 2 0.4215837E-03 3 0.6312734E-04 4 0.8110704E-05 5 0.2185167E-06 6 0.1001279E-06 7 0.2555458E-08 8 0.2076262E-08 9 0.4642248E-08 v, j, mj = 0 4 1 0 0.2103358E-16 1 0.8404484E-04 2 0.9191447E-04 3 0.5082987E-04 4 0.7946678E-05 5 0.4152327E-06 6 0.7023925E-07 7 0.6726900E-08 8 0.6396005E-09 9 0.5405319E-10 v, j, mj = 0 4 2 0 0.5039810E-14 1 0.9790995E-05 2 0.3230005E-04 3 0.1907889E-04 4 0.3702451E-05 5 0.2136637E-06 6 0.2806734E-07 7 0.3651930E-08 8 0.3287397E-08 9 0.2072302E-08 v, j, mj = 0 4 3 0 0.8238597E-09 1 0.1501154E-06 2 0.2332928E-05 3 0.3741537E-05 4 0.1484443E-05 5 0.1603802E-06 6 0.1715049E-07 7 0.7405047E-08 8 0.2011781E-08 9 0.7313989E-09 v, j, mj = 0 4 4 0 0.1770716E-15 1 0.1370069E-08 2 0.4155510E-07 3 0.3551559E-06 4 0.3447575E-06 5 0.6562607E-07 6 0.8129264E-08 7 0.1067352E-08 8 0.7939945E-09 9 0.4791907E-09 v, j, mj = 0 6 -6 0 0.7941276E-12 1 0.1620590E-09 2 0.2452502E-08 3 0.2812865E-07 4 0.2510146E-07 5 0.3639606E-08 6 0.1069658E-07 7 0.4621372E-08 8 0.5319856E-09 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.3229280E-16 1 0.4166735E-08 2 0.1038386E-06 3 0.4527281E-06 4 0.2004532E-06 5 0.2311564E-07 6 0.2409370E-07 7 0.4790924E-08 8 0.7660772E-09 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.1108199E-14 1 0.3338754E-07 2 0.2467690E-05 3 0.3414756E-05 4 0.6631177E-06 5 0.7516994E-07 6 0.5961586E-07 7 0.1595037E-07 8 0.1937611E-09 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.3426333E-07 1 0.3258529E-05 2 0.1844600E-04 3 0.1349845E-04 4 0.1297304E-05 5 0.5830600E-07 6 0.4700054E-07 7 0.2667149E-08 8 0.1490994E-09 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.1474290E-13 1 0.9819696E-04 2 0.1465078E-03 3 0.2222435E-04 4 0.4532034E-06 5 0.1240376E-06 6 0.8784205E-08 7 0.6929495E-08 8 0.3156258E-09 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.1274150E-16 1 0.2946721E-03 2 0.1685389E-03 3 0.6466418E-05 4 0.7314290E-06 5 0.1387703E-06 6 0.7594893E-08 7 0.2226873E-08 8 0.8795972E-10 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.4060752E-02 1 0.4647977E-02 2 0.3537358E-03 3 0.5114117E-05 4 0.2871309E-05 5 0.2499396E-06 6 0.2983179E-07 7 0.2883328E-07 8 0.1174583E-08 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.5004611E-16 1 0.2946721E-03 2 0.1685388E-03 3 0.6466417E-05 4 0.7314304E-06 5 0.1387699E-06 6 0.7594897E-08 7 0.2226872E-08 8 0.8795970E-10 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.1545682E-13 1 0.9819695E-04 2 0.1465078E-03 3 0.2222435E-04 4 0.4532042E-06 5 0.1240378E-06 6 0.8784219E-08 7 0.6929495E-08 8 0.3156258E-09 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.3426275E-07 1 0.3258529E-05 2 0.1844600E-04 3 0.1349845E-04 4 0.1297304E-05 5 0.5830594E-07 6 0.4700057E-07 7 0.2667149E-08 8 0.1490994E-09 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.1115931E-14 1 0.3338658E-07 2 0.2467691E-05 3 0.3414755E-05 4 0.6631171E-06 5 0.7516998E-07 6 0.5961586E-07 7 0.1595038E-07 8 0.1937611E-09 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.2996342E-16 1 0.4166500E-08 2 0.1038387E-06 3 0.4527281E-06 4 0.2004531E-06 5 0.2311564E-07 6 0.2409370E-07 7 0.4790924E-08 8 0.7660771E-09 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.7941258E-12 1 0.1620453E-09 2 0.2452546E-08 3 0.2812873E-07 4 0.2510145E-07 5 0.3639606E-08 6 0.1069658E-07 7 0.4621372E-08 8 0.5319856E-09 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.4419732E-18 1 0.3123530E-10 2 0.3823039E-10 3 0.1628099E-10 4 0.1883938E-09 5 0.2142625E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1725702E-18 1 0.8720583E-09 2 0.1228740E-09 3 0.4033796E-09 4 0.5355356E-09 5 0.5473794E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.9318327E-08 1 0.2305873E-07 2 0.4668909E-07 3 0.6795876E-08 4 0.4447823E-07 5 0.2305414E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.2633973E-18 1 0.1223088E-06 2 0.1430497E-06 3 0.7756222E-07 4 0.2618019E-07 5 0.4089964E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1031906E-16 1 0.5117168E-05 2 0.9511329E-05 3 0.1449662E-05 4 0.1674321E-05 5 0.1952061E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.1320609E-06 1 0.2574131E-04 2 0.3489767E-04 3 0.4916524E-05 4 0.2400716E-06 5 0.2262566E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.2310677E-15 1 0.4474425E-02 2 0.1362412E-02 3 0.5524832E-04 4 0.3897187E-05 5 0.1288757E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.3415580E-17 1 0.9907379E-03 2 0.2145045E-03 3 0.9202122E-05 4 0.1774496E-06 5 0.2373774E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.6048526E+00 1 0.3241259E+00 2 0.3115236E-01 3 0.1008755E-02 4 0.1758411E-04 5 0.1245849E-05 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.3738230E-17 1 0.9907379E-03 2 0.2145045E-03 3 0.9202122E-05 4 0.1774496E-06 5 0.2373773E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.2270290E-15 1 0.4474425E-02 2 0.1362412E-02 3 0.5524832E-04 4 0.3897187E-05 5 0.1288757E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.1320613E-06 1 0.2574131E-04 2 0.3489767E-04 3 0.4916524E-05 4 0.2400716E-06 5 0.2262566E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.7461345E-17 1 0.5117168E-05 2 0.9511329E-05 3 0.1449662E-05 4 0.1674321E-05 5 0.1952061E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.3308203E-18 1 0.1223088E-06 2 0.1430498E-06 3 0.7756221E-07 4 0.2618019E-07 5 0.4089964E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.9318327E-08 1 0.2305873E-07 2 0.4668908E-07 3 0.6795877E-08 4 0.4447823E-07 5 0.2305414E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.8416932E-19 1 0.8720566E-09 2 0.1228739E-09 3 0.4033797E-09 4 0.5355356E-09 5 0.5473795E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.4248163E-18 1 0.3123497E-10 2 0.3823099E-10 3 0.1628117E-10 4 0.1883939E-09 5 0.2142624E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.1576745E-05 1 0.1241240E-05 2 0.5707286E-06 3 0.6352421E-07 4 0.1458507E-07 5 0.5423812E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.7646779E-18 1 0.8691222E-07 2 0.8973161E-07 3 0.1356241E-07 4 0.3763241E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.6766632E-19 1 0.1879686E-05 2 0.4010856E-06 3 0.3016701E-07 4 0.4962234E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.7227889E-05 1 0.6165443E-05 2 0.2023252E-05 3 0.3039571E-06 4 0.1539848E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.1771534E-19 1 0.1879686E-05 2 0.4010856E-06 3 0.3016701E-07 4 0.4962234E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.4439608E-18 1 0.8691223E-07 2 0.8973160E-07 3 0.1356241E-07 4 0.3763242E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.4129403E-18 1 0.3742512E-10 2 0.1411062E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.6479253E-10 1 0.4469803E-09 2 0.3150998E-08 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.1286839E-18 1 0.4378014E-07 2 0.1509567E-07 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.9663981E-20 1 0.1205651E-05 2 0.5720057E-07 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.1134077E-04 1 0.8897987E-05 2 0.4363706E-06 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.8011532E-20 1 0.1205651E-05 2 0.5720057E-07 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.1266857E-18 1 0.4378014E-07 2 0.1509567E-07 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.6479306E-10 1 0.4469802E-09 2 0.3150998E-08 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.4046212E-18 1 0.3742511E-10 2 0.1411062E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9893425 average vibrational energy (ev) = 0.000024 average rotational energy (ev) = 0.491651 average diffraction energy (ev) = 0.003919 the reaction probability = 0.1065754D-01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.41272524D+01 trans energy = 0.26428571D+00 trans energy in z = 0.26428571D+00 total momentum = 0.84480953D+01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.1004491E+01 0.3990359E-02 0.4852033E+00 1 0.2836662E-03 0.8920550E-02 0.1096253E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.5234634E-03 0 31 2 -2 0.2020095E-04 0 37 2 -1 0.2167110E-03 0 44 2 0 0.2110586E-02 0 50 2 1 0.2167110E-03 0 56 2 2 0.2020096E-04 0 21 4 -4 0.1621324E-05 0 26 4 -3 0.3247289E-04 0 32 4 -2 0.3021903E-03 0 38 4 -1 0.8872597E-03 0 45 4 0 0.5268923E-02 0 51 4 1 0.8872597E-03 0 57 4 2 0.3021903E-03 0 62 4 3 0.3247289E-04 0 67 4 4 0.1621322E-05 0 13 6 -6 0.1199821E-05 0 17 6 -5 0.9380887E-05 0 22 6 -4 0.5763256E-04 0 27 6 -3 0.2607701E-03 0 33 6 -2 0.1305241E-02 0 39 6 -1 0.1448485E-02 0 46 6 0 0.2242420E-01 0 52 6 1 0.1448485E-02 0 58 6 2 0.1305241E-02 0 63 6 3 0.2607701E-03 0 68 6 4 0.5763255E-04 0 72 6 5 0.9380886E-05 0 76 6 6 0.1199820E-05 0 7 8 -8 0.2038082E-08 0 10 8 -7 0.1879894E-07 0 14 8 -6 0.2606402E-06 0 18 8 -5 0.2047604E-05 0 23 8 -4 0.5784096E-04 0 28 8 -3 0.3247247E-03 0 34 8 -2 0.1247908E-01 0 40 8 -1 0.2747651E-02 0 47 8 0 0.9338535E+00 0 53 8 1 0.2747651E-02 0 59 8 2 0.1247908E-01 0 64 8 3 0.3247247E-03 0 69 8 4 0.5784096E-04 0 73 8 5 0.2047604E-05 0 77 8 6 0.2606399E-06 0 80 8 7 0.1879884E-07 0 83 8 8 0.2038073E-08 0 3 10 -10 0.1014758E-12 0 5 10 -9 0.2648806E-12 0 8 10 -8 0.2706172E-11 0 11 10 -7 0.3499944E-11 0 15 10 -6 0.1211094E-07 0 19 10 -5 0.3125034E-10 0 24 10 -4 0.2682154E-08 0 29 10 -3 0.1604390E-07 0 35 10 -2 0.1761815E-07 0 41 10 -1 0.4108838E-06 0 48 10 0 0.2176447E-06 0 54 10 1 0.4108838E-06 0 60 10 2 0.1761815E-07 0 65 10 3 0.1604390E-07 0 70 10 4 0.2682155E-08 0 74 10 5 0.3125030E-10 0 78 10 6 0.1211094E-07 0 81 10 7 0.3499938E-11 0 84 10 8 0.2706159E-11 0 86 10 9 0.2648798E-12 0 88 10 10 0.1014767E-12 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.3467847E-04 1 31 2 -2 0.2551881E-05 1 37 2 -1 0.1209521E-04 1 44 2 0 0.1543938E-04 1 50 2 1 0.1209521E-04 1 56 2 2 0.2551881E-05 1 21 4 -4 0.4073924E-08 1 26 4 -3 0.5454017E-07 1 32 4 -2 0.1165776E-05 1 38 4 -1 0.1602949E-04 1 45 4 0 0.1697464E-03 1 51 4 1 0.1602949E-04 1 57 4 2 0.1165776E-05 1 62 4 3 0.5454018E-07 1 67 4 4 0.4073925E-08 1 13 6 -6 0.0000000E+00 1 17 6 -5 0.0000000E+00 1 22 6 -4 0.0000000E+00 1 27 6 -3 0.0000000E+00 1 33 6 -2 0.0000000E+00 1 39 6 -1 0.0000000E+00 1 46 6 0 0.0000000E+00 1 52 6 1 0.0000000E+00 1 58 6 2 0.0000000E+00 1 63 6 3 0.0000000E+00 1 68 6 4 0.0000000E+00 1 72 6 5 0.0000000E+00 1 76 6 6 0.0000000E+00 1 7 8 -8 0.0000000E+00 1 10 8 -7 0.0000000E+00 1 14 8 -6 0.0000000E+00 1 18 8 -5 0.0000000E+00 1 23 8 -4 0.0000000E+00 1 28 8 -3 0.0000000E+00 1 34 8 -2 0.0000000E+00 1 40 8 -1 0.0000000E+00 1 47 8 0 0.0000000E+00 1 53 8 1 0.0000000E+00 1 59 8 2 0.0000000E+00 1 64 8 3 0.0000000E+00 1 69 8 4 0.0000000E+00 1 73 8 5 0.0000000E+00 1 77 8 6 0.0000000E+00 1 80 8 7 0.0000000E+00 1 83 8 8 0.0000000E+00 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.3631264E-05 1 0.1080064E-03 2 0.3045147E-03 3 0.1041390E-03 4 0.2885029E-05 5 0.2557723E-06 6 0.1232217E-07 7 0.1282408E-07 8 0.4701423E-08 9 0.1392296E-08 v, j, mj = 0 2 -2 0 0.4038400E-14 1 0.3363579E-05 2 0.1102229E-04 3 0.5133356E-05 4 0.5663497E-06 5 0.7638701E-07 6 0.3058679E-07 7 0.7182404E-08 8 0.7681230E-09 9 0.4538421E-09 v, j, mj = 0 2 -1 0 0.3708364E-16 1 0.9363566E-04 2 0.7216858E-04 3 0.4333981E-04 4 0.7413690E-05 5 0.8382611E-07 6 0.5610941E-07 7 0.9557495E-08 8 0.3212632E-08 9 0.5860223E-09 v, j, mj = 0 2 0 0 0.5909088E-04 1 0.6788427E-03 2 0.1076873E-02 3 0.2863395E-03 4 0.9076351E-05 5 0.2439022E-06 6 0.9542537E-07 7 0.2016221E-07 8 0.3432919E-08 9 0.1040618E-08 v, j, mj = 0 2 1 0 0.4346130E-16 1 0.9363566E-04 2 0.7216858E-04 3 0.4333981E-04 4 0.7413690E-05 5 0.8383030E-07 6 0.5611017E-07 7 0.9557606E-08 8 0.3212696E-08 9 0.5860270E-09 v, j, mj = 0 2 2 0 0.5280129E-14 1 0.3363579E-05 2 0.1102229E-04 3 0.5133356E-05 4 0.5663502E-06 5 0.7638782E-07 6 0.3058752E-07 7 0.7182244E-08 8 0.7681128E-09 9 0.4538411E-09 v, j, mj = 0 4 -4 0 0.1096761E-14 1 0.2367181E-08 2 0.4170437E-07 3 0.7067379E-06 4 0.6967396E-06 5 0.1542636E-06 6 0.1629206E-07 7 0.1812406E-08 8 0.6972639E-09 9 0.7100344E-09 v, j, mj = 0 4 -3 0 0.9275697E-09 1 0.1147639E-05 2 0.1097492E-04 3 0.1401579E-04 4 0.5536171E-05 5 0.7511153E-06 6 0.4031934E-07 7 0.3076249E-08 8 0.1800592E-08 9 0.1129398E-08 v, j, mj = 0 4 -2 0 0.4414204E-13 1 0.5678928E-04 2 0.1481269E-03 3 0.7856009E-04 4 0.1758862E-04 5 0.1053034E-05 6 0.5124298E-07 7 0.1535305E-07 8 0.3797092E-08 9 0.1953734E-08 v, j, mj = 0 4 -1 0 0.2480385E-15 1 0.3361299E-03 2 0.3009001E-03 3 0.2179224E-03 4 0.3154015E-04 5 0.6835725E-06 6 0.7513418E-07 7 0.7005152E-08 8 0.1156648E-08 9 0.2096897E-09 v, j, mj = 0 4 0 0 0.9017105E-03 1 0.2620312E-02 2 0.1419351E-02 3 0.2826394E-03 4 0.4389214E-04 5 0.7780311E-06 6 0.2274967E-06 7 0.6750605E-08 8 0.3587865E-08 9 0.2778325E-08 v, j, mj = 0 4 1 0 0.6647769E-15 1 0.3361299E-03 2 0.3009001E-03 3 0.2179224E-03 4 0.3154017E-04 5 0.6835709E-06 6 0.7513642E-07 7 0.7005236E-08 8 0.1156652E-08 9 0.2096897E-09 v, j, mj = 0 4 2 0 0.5244215E-13 1 0.5678928E-04 2 0.1481269E-03 3 0.7856009E-04 4 0.1758862E-04 5 0.1053034E-05 6 0.5124249E-07 7 0.1535315E-07 8 0.3797103E-08 9 0.1953734E-08 v, j, mj = 0 4 3 0 0.9282552E-09 1 0.1147639E-05 2 0.1097492E-04 3 0.1401579E-04 4 0.5536168E-05 5 0.7511151E-06 6 0.4031893E-07 7 0.3076173E-08 8 0.1800588E-08 9 0.1129398E-08 v, j, mj = 0 4 4 0 0.7029709E-15 1 0.2367220E-08 2 0.4170444E-07 3 0.7067366E-06 4 0.6967388E-06 5 0.1542634E-06 6 0.1629197E-07 7 0.1812398E-08 8 0.6972632E-09 9 0.7100341E-09 v, j, mj = 0 6 -6 0 0.5519102E-09 1 0.1490065E-08 2 0.3840317E-07 3 0.5323871E-06 4 0.5278217E-06 5 0.8826956E-07 6 0.6714574E-08 7 0.2106944E-08 8 0.2076369E-08 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.6510247E-15 1 0.2353280E-07 2 0.1253084E-05 3 0.5336950E-05 4 0.2502867E-05 5 0.2052306E-06 6 0.4641737E-07 7 0.1087942E-07 8 0.1925482E-08 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.1876778E-13 1 0.2650429E-06 2 0.2110350E-04 3 0.2987793E-04 4 0.6013637E-05 5 0.3301309E-06 6 0.3164663E-07 7 0.8320269E-08 8 0.2344166E-08 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.5097747E-07 1 0.1886519E-04 2 0.1415886E-03 3 0.9322678E-04 4 0.6919101E-05 5 0.5712484E-07 6 0.5079374E-07 7 0.1087114E-07 8 0.6390786E-09 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.2275029E-12 1 0.5067691E-03 2 0.7025394E-03 3 0.9189102E-04 4 0.3633429E-05 5 0.3897241E-06 6 0.1532280E-07 7 0.1973659E-08 8 0.7303065E-09 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.6684309E-16 1 0.1006580E-02 2 0.4168211E-03 3 0.2016297E-04 4 0.4402225E-05 5 0.4987781E-06 6 0.1391230E-07 7 0.4847173E-08 8 0.1371911E-08 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.1182597E-01 1 0.1017676E-01 2 0.3419023E-03 3 0.6876236E-04 4 0.1049730E-04 5 0.2146765E-06 6 0.6308554E-07 7 0.1271169E-07 8 0.4239729E-08 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.8934311E-15 1 0.1006579E-02 2 0.4168210E-03 3 0.2016295E-04 4 0.4402229E-05 5 0.4987767E-06 6 0.1391244E-07 7 0.4847162E-08 8 0.1371912E-08 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.2499702E-12 1 0.5067691E-03 2 0.7025394E-03 3 0.9189101E-04 4 0.3633426E-05 5 0.3897250E-06 6 0.1532285E-07 7 0.1973659E-08 8 0.7303070E-09 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.5097818E-07 1 0.1886519E-04 2 0.1415886E-03 3 0.9322678E-04 4 0.6919100E-05 5 0.5712443E-07 6 0.5079382E-07 7 0.1087114E-07 8 0.6390786E-09 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.1865537E-13 1 0.2650370E-06 2 0.2110351E-04 3 0.2987793E-04 4 0.6013636E-05 5 0.3301314E-06 6 0.3164657E-07 7 0.8320266E-08 8 0.2344166E-08 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.6583022E-15 1 0.2353178E-07 2 0.1253085E-05 3 0.5336950E-05 4 0.2502867E-05 5 0.2052306E-06 6 0.4641734E-07 7 0.1087943E-07 8 0.1925483E-08 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.5519124E-09 1 0.1490020E-08 2 0.3840268E-07 3 0.5323873E-06 4 0.5278206E-06 5 0.8826925E-07 6 0.6714595E-08 7 0.2106946E-08 8 0.2076369E-08 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.1363184E-16 1 0.8359739E-10 2 0.2977257E-09 3 0.1404277E-09 4 0.1813350E-09 5 0.5455408E-09 6 0.7894558E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.2336278E-17 1 0.1822289E-08 2 0.2742638E-08 3 0.2510574E-08 4 0.1576355E-08 5 0.8401740E-08 6 0.1745349E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.1735219E-07 1 0.1745541E-07 2 0.9087895E-07 3 0.4890685E-07 4 0.5199956E-07 5 0.1284786E-07 6 0.2119942E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.2101561E-16 1 0.2700967E-06 2 0.8707577E-06 3 0.6921746E-06 4 0.9416507E-07 5 0.1155698E-06 6 0.4840151E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1442486E-14 1 0.1313443E-04 2 0.3353909E-04 3 0.8863365E-05 4 0.2212364E-05 5 0.8252352E-07 6 0.9187031E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.1987054E-06 1 0.8948395E-04 2 0.2033701E-03 3 0.3084720E-04 4 0.6663653E-06 5 0.1503167E-06 6 0.8059346E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1939598E-13 1 0.9470501E-02 2 0.2852567E-02 3 0.1455850E-03 4 0.1016957E-04 5 0.5415879E-07 6 0.2037391E-06 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.1436440E-15 1 0.2340419E-02 2 0.3831460E-03 3 0.2343468E-04 4 0.6402891E-06 5 0.9642937E-08 6 0.1889042E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.6366952E+00 1 0.2628936E+00 2 0.3253274E-01 3 0.1692987E-02 4 0.3865462E-04 5 0.3645857E-06 6 0.4040123E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.1317139E-15 1 0.2340419E-02 2 0.3831460E-03 3 0.2343468E-04 4 0.6402894E-06 5 0.9642925E-08 6 0.1889043E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.2062157E-13 1 0.9470501E-02 2 0.2852567E-02 3 0.1455850E-03 4 0.1016957E-04 5 0.5415879E-07 6 0.2037391E-06 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.1987020E-06 1 0.8948395E-04 2 0.2033701E-03 3 0.3084720E-04 4 0.6663653E-06 5 0.1503167E-06 6 0.8059345E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.9646616E-15 1 0.1313443E-04 2 0.3353910E-04 3 0.8863365E-05 4 0.2212364E-05 5 0.8252351E-07 6 0.9187030E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.3891015E-16 1 0.2700962E-06 2 0.8707582E-06 3 0.6921746E-06 4 0.9416499E-07 5 0.1155698E-06 6 0.4840151E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1735219E-07 1 0.1745541E-07 2 0.9087871E-07 3 0.4890683E-07 4 0.5199952E-07 5 0.1284786E-07 6 0.2119942E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.4214248E-17 1 0.1822232E-08 2 0.2742606E-08 3 0.2510552E-08 4 0.1576361E-08 5 0.8401741E-08 6 0.1745349E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.1666125E-16 1 0.8356522E-10 2 0.2977263E-09 3 0.1404487E-09 4 0.1813355E-09 5 0.5455413E-09 6 0.7894559E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.2958792E-19 1 0.9842602E-13 2 0.3049725E-14 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.9735509E-13 1 0.1634512E-12 2 0.4074219E-14 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.4946656E-19 1 0.2631477E-11 2 0.7469471E-13 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.1610172E-19 1 0.3411551E-11 2 0.8839250E-13 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.1010298E-07 1 0.1932554E-08 2 0.7540647E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.4390796E-20 1 0.2894581E-10 2 0.2304523E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.1211223E-18 1 0.2589893E-08 2 0.9226133E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.1045485E-09 1 0.1593003E-07 2 0.9318210E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.1071627E-18 1 0.1759309E-07 2 0.2505961E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.1570459E-19 1 0.4102127E-06 2 0.6710680E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.1626762E-06 1 0.5420377E-07 2 0.7647030E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.3531895E-19 1 0.4102127E-06 2 0.6710679E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.1145117E-18 1 0.1759309E-07 2 0.2505961E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.1045489E-09 1 0.1593003E-07 2 0.9318209E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.1223216E-18 1 0.2589893E-08 2 0.9226132E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.5269535E-20 1 0.2894577E-10 2 0.2304527E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.1010298E-07 1 0.1932554E-08 2 0.7540647E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.1618685E-19 1 0.3411545E-11 2 0.8839257E-13 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.5004362E-19 1 0.2631465E-11 2 0.7469459E-13 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.9735675E-13 1 0.1634489E-12 2 0.4074150E-14 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.2943361E-19 1 0.9842703E-13 2 0.3049685E-14 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.9202106E-05 1 0.1369735E-04 2 0.9632114E-05 3 0.1845702E-05 4 0.2877675E-06 5 0.1274951E-07 6 0.6789582E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.4099175E-15 1 0.1090949E-05 2 0.1346827E-05 3 0.8736038E-07 4 0.1267285E-07 5 0.1407206E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.1310564E-16 1 0.1034007E-04 2 0.8796946E-06 3 0.8181250E-06 4 0.5099204E-07 5 0.6329609E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.6391399E-05 1 0.2611014E-05 2 0.5002456E-05 3 0.1290810E-05 4 0.1297286E-06 5 0.1397306E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.9510441E-17 1 0.1034007E-04 2 0.8796948E-06 3 0.8181247E-06 4 0.5099202E-07 5 0.6329608E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.2838630E-15 1 0.1090949E-05 2 0.1346827E-05 3 0.8736040E-07 4 0.1267285E-07 5 0.1407206E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.1112584E-17 1 0.4162817E-10 2 0.7279517E-09 3 0.2186919E-08 4 0.1117425E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.7308354E-10 1 0.1759667E-07 2 0.3057412E-07 3 0.3427826E-08 4 0.2868475E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.7254650E-17 1 0.6386023E-06 2 0.4707713E-06 3 0.5458393E-07 4 0.1818886E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.7479390E-18 1 0.1299720E-04 2 0.3004440E-05 3 0.2578851E-07 4 0.2061815E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.7919001E-04 1 0.8363268E-04 2 0.6722865E-05 3 0.1982539E-06 4 0.2637755E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.7415420E-18 1 0.1299720E-04 2 0.3004440E-05 3 0.2578851E-07 4 0.2061816E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.2229264E-17 1 0.6386023E-06 2 0.4707714E-06 3 0.5458393E-07 4 0.1818887E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.7309620E-10 1 0.1759666E-07 2 0.3057411E-07 3 0.3427825E-08 4 0.2868476E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.1216218E-17 1 0.4163147E-10 2 0.7279497E-09 3 0.2186919E-08 4 0.1117425E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 1.0047751 average vibrational energy (ev) = 0.000144 average rotational energy (ev) = 0.485097 average diffraction energy (ev) = 0.003992 the reaction probability = -0.4775062D-02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.40701096D+01 trans energy = 0.32142857D+00 trans energy in z = 0.32142857D+00 total momentum = 0.93167448D+01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9942360E+00 0.3980587E-02 0.4736622E+00 1 0.1555939E-02 0.1488909E-01 0.8736188E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.1207735E-02 0 31 2 -2 0.6611049E-04 0 37 2 -1 0.6478094E-03 0 44 2 0 0.4870216E-02 0 50 2 1 0.6478094E-03 0 56 2 2 0.6611051E-04 0 21 4 -4 0.1548378E-05 0 26 4 -3 0.7453824E-04 0 32 4 -2 0.8789011E-03 0 38 4 -1 0.2271697E-02 0 45 4 0 0.1123914E-01 0 51 4 1 0.2271697E-02 0 57 4 2 0.8789011E-03 0 62 4 3 0.7453823E-04 0 67 4 4 0.1548372E-05 0 13 6 -6 0.1253075E-04 0 17 6 -5 0.6599237E-04 0 22 6 -4 0.3092409E-03 0 27 6 -3 0.1148286E-02 0 33 6 -2 0.4127013E-02 0 39 6 -1 0.2996566E-02 0 46 6 0 0.4051145E-01 0 52 6 1 0.2996565E-02 0 58 6 2 0.4127013E-02 0 63 6 3 0.1148286E-02 0 68 6 4 0.3092409E-03 0 72 6 5 0.6599237E-04 0 76 6 6 0.1253075E-04 0 7 8 -8 0.1236026E-07 0 10 8 -7 0.7966356E-07 0 14 8 -6 0.8538457E-06 0 18 8 -5 0.1653606E-04 0 23 8 -4 0.2363644E-03 0 28 8 -3 0.1373380E-02 0 34 8 -2 0.2355279E-01 0 40 8 -1 0.5235232E-02 0 47 8 0 0.8503522E+00 0 53 8 1 0.5235232E-02 0 59 8 2 0.2355279E-01 0 64 8 3 0.1373379E-02 0 69 8 4 0.2363645E-03 0 73 8 5 0.1653605E-04 0 77 8 6 0.8538428E-06 0 80 8 7 0.7966204E-07 0 83 8 8 0.1235971E-07 0 3 10 -10 0.1128407E-10 0 5 10 -9 0.2600108E-10 0 8 10 -8 0.2265575E-09 0 11 10 -7 0.3271288E-09 0 15 10 -6 0.3691402E-07 0 19 10 -5 0.4551865E-08 0 24 10 -4 0.2784565E-06 0 29 10 -3 0.1448653E-06 0 35 10 -2 0.1424567E-06 0 41 10 -1 0.1439351E-05 0 48 10 0 0.2014033E-04 0 54 10 1 0.1439351E-05 0 60 10 2 0.1424567E-06 0 65 10 3 0.1448654E-06 0 70 10 4 0.2784565E-06 0 74 10 5 0.4551868E-08 0 78 10 6 0.3691402E-07 0 81 10 7 0.3271301E-09 0 84 10 8 0.2265580E-09 0 86 10 9 0.2600121E-10 0 88 10 10 0.1128405E-10 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.8389210E-04 1 31 2 -2 0.1288995E-03 1 37 2 -1 0.9742443E-04 1 44 2 0 0.2941339E-03 1 50 2 1 0.9742442E-04 1 56 2 2 0.1288996E-03 1 21 4 -4 0.5052001E-07 1 26 4 -3 0.1857109E-05 1 32 4 -2 0.1994243E-04 1 38 4 -1 0.9105176E-04 1 45 4 0 0.4990521E-03 1 51 4 1 0.9105176E-04 1 57 4 2 0.1994243E-04 1 62 4 3 0.1857108E-05 1 67 4 4 0.5052094E-07 1 13 6 -6 0.1051614E-09 1 17 6 -5 0.2323755E-10 1 22 6 -4 0.1867872E-09 1 27 6 -3 0.1318164E-08 1 33 6 -2 0.1056489E-07 1 39 6 -1 0.6567646E-08 1 46 6 0 0.3721069E-06 1 52 6 1 0.6567645E-08 1 58 6 2 0.1056488E-07 1 63 6 3 0.1318164E-08 1 68 6 4 0.1867859E-09 1 72 6 5 0.2323750E-10 1 76 6 6 0.1051614E-09 1 7 8 -8 0.0000000E+00 1 10 8 -7 0.0000000E+00 1 14 8 -6 0.0000000E+00 1 18 8 -5 0.0000000E+00 1 23 8 -4 0.0000000E+00 1 28 8 -3 0.0000000E+00 1 34 8 -2 0.0000000E+00 1 40 8 -1 0.0000000E+00 1 47 8 0 0.0000000E+00 1 53 8 1 0.0000000E+00 1 59 8 2 0.0000000E+00 1 64 8 3 0.0000000E+00 1 69 8 4 0.0000000E+00 1 73 8 5 0.0000000E+00 1 77 8 6 0.0000000E+00 1 80 8 7 0.0000000E+00 1 83 8 8 0.0000000E+00 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.2460297E-04 1 0.1987837E-03 2 0.7416243E-03 3 0.2383128E-03 4 0.3118844E-05 5 0.1234413E-05 6 0.4079389E-07 7 0.1055397E-07 8 0.5176241E-08 9 0.9989285E-09 v, j, mj = 0 2 -2 0 0.3042496E-13 1 0.1430806E-04 2 0.3814525E-04 3 0.1198130E-04 4 0.1416531E-05 5 0.1873006E-06 6 0.4728250E-07 7 0.1985181E-07 8 0.4145533E-08 9 0.7682461E-09 v, j, mj = 0 2 -1 0 0.9007083E-15 1 0.3062853E-03 2 0.1858667E-03 3 0.1414044E-03 4 0.1341391E-04 5 0.7065123E-06 6 0.9340616E-07 7 0.3480712E-07 8 0.4075366E-08 9 0.2251833E-09 v, j, mj = 0 2 0 0 0.5103309E-04 1 0.1387359E-02 2 0.2655142E-02 3 0.7563131E-03 4 0.1844758E-04 5 0.1712176E-05 6 0.1684008E-06 7 0.3444102E-07 8 0.4937239E-08 9 0.1164600E-08 v, j, mj = 0 2 1 0 0.2523475E-14 1 0.3062853E-03 2 0.1858668E-03 3 0.1414044E-03 4 0.1341391E-04 5 0.7065243E-06 6 0.9340646E-07 7 0.3480734E-07 8 0.4075472E-08 9 0.2251936E-09 v, j, mj = 0 2 2 0 0.2959672E-13 1 0.1430806E-04 2 0.3814526E-04 3 0.1198130E-04 4 0.1416532E-05 5 0.1873021E-06 6 0.4728397E-07 7 0.1985163E-07 8 0.4145571E-08 9 0.7682466E-09 v, j, mj = 0 4 -4 0 0.3558632E-14 1 0.2558644E-07 2 0.3311990E-06 3 0.2651058E-06 4 0.6376426E-06 5 0.2260759E-06 6 0.5441829E-07 7 0.6189092E-08 8 0.1135908E-08 9 0.1024509E-08 v, j, mj = 0 4 -3 0 0.8793908E-08 1 0.6327208E-05 2 0.3270826E-04 3 0.2284233E-04 4 0.1051946E-04 5 0.2014447E-05 6 0.1074712E-06 7 0.6989634E-08 8 0.1782590E-08 9 0.1502830E-08 v, j, mj = 0 4 -2 0 0.1770045E-12 1 0.2132757E-03 2 0.4499826E-03 3 0.1729554E-03 4 0.4089181E-04 5 0.1644720E-05 6 0.1319527E-06 7 0.1677515E-07 8 0.1403795E-08 9 0.7022286E-09 v, j, mj = 0 4 -1 0 0.2197176E-14 1 0.9826225E-03 2 0.6596401E-03 3 0.5617499E-03 4 0.6720637E-04 5 0.3679449E-06 6 0.9773545E-07 7 0.1023836E-07 8 0.1068819E-08 9 0.7697255E-09 v, j, mj = 0 4 0 0 0.1445370E-02 1 0.5269951E-02 2 0.3301405E-02 3 0.1109102E-02 4 0.1123060E-03 5 0.6231032E-06 6 0.3553358E-06 7 0.2436944E-07 8 0.2049959E-08 9 0.2668802E-08 v, j, mj = 0 4 1 0 0.4301222E-14 1 0.9826226E-03 2 0.6596401E-03 3 0.5617498E-03 4 0.6720639E-04 5 0.3679348E-06 6 0.9774606E-07 7 0.1023890E-07 8 0.1068817E-08 9 0.7697260E-09 v, j, mj = 0 4 2 0 0.2085590E-12 1 0.2132757E-03 2 0.4499826E-03 3 0.1729554E-03 4 0.4089180E-04 5 0.1644718E-05 6 0.1319489E-06 7 0.1677546E-07 8 0.1403754E-08 9 0.7022265E-09 v, j, mj = 0 4 3 0 0.8792790E-08 1 0.6327209E-05 2 0.3270826E-04 3 0.2284232E-04 4 0.1051946E-04 5 0.2014444E-05 6 0.1074688E-06 7 0.6989177E-08 8 0.1782581E-08 9 0.1502828E-08 v, j, mj = 0 4 4 0 0.2756594E-14 1 0.2558563E-07 2 0.3312000E-06 3 0.2651034E-06 4 0.6376416E-06 5 0.2260738E-06 6 0.5441813E-07 7 0.6189046E-08 8 0.1135904E-08 9 0.1024510E-08 v, j, mj = 0 6 -6 0 0.1750250E-07 1 0.2069059E-07 2 0.4179133E-06 3 0.5349632E-05 4 0.5506306E-05 5 0.1164856E-05 6 0.4590223E-07 7 0.4622327E-08 8 0.3129507E-08 9 0.1999756E-09 v, j, mj = 0 6 -5 0 0.6411712E-14 1 0.1779310E-06 2 0.1012592E-04 3 0.3765942E-04 4 0.1621896E-04 5 0.1742840E-05 6 0.5571689E-07 7 0.8234626E-08 8 0.3168157E-08 9 0.1764248E-09 v, j, mj = 0 6 -4 0 0.1518756E-12 1 0.1573731E-05 2 0.1250715E-03 3 0.1544642E-03 4 0.2716653E-04 5 0.9200801E-06 6 0.3255795E-07 7 0.1047027E-07 8 0.1738479E-08 9 0.2228546E-09 v, j, mj = 0 6 -3 0 0.9125048E-07 1 0.9242083E-04 2 0.6708637E-03 3 0.3631263E-03 4 0.2131032E-04 5 0.4022178E-06 6 0.6189776E-07 7 0.6501455E-08 8 0.2732293E-08 9 0.9945391E-10 v, j, mj = 0 6 -2 0 0.1525965E-11 1 0.1772437E-02 2 0.2073054E-02 3 0.2570829E-03 4 0.2338342E-04 5 0.1006085E-05 6 0.4184498E-07 7 0.6101958E-08 8 0.1954255E-08 9 0.2057046E-09 v, j, mj = 0 6 -1 0 0.1456567E-14 1 0.2242802E-02 2 0.5627708E-03 3 0.1545133E-03 4 0.3474197E-04 5 0.1705815E-05 6 0.2354314E-07 7 0.6922789E-08 8 0.1242532E-08 9 0.1720267E-09 v, j, mj = 0 6 0 0 0.2309618E-01 1 0.1586480E-01 2 0.1061676E-02 3 0.4607425E-03 4 0.2712940E-04 5 0.8320217E-06 6 0.8237079E-07 7 0.9932648E-08 8 0.5439342E-08 9 0.1203763E-09 v, j, mj = 0 6 1 0 0.8872157E-14 1 0.2242802E-02 2 0.5627705E-03 3 0.1545132E-03 4 0.3474196E-04 5 0.1705814E-05 6 0.2354336E-07 7 0.6922750E-08 8 0.1242536E-08 9 0.1720269E-09 v, j, mj = 0 6 2 0 0.1713739E-11 1 0.1772437E-02 2 0.2073054E-02 3 0.2570829E-03 4 0.2338341E-04 5 0.1006087E-05 6 0.4184490E-07 7 0.6101969E-08 8 0.1954254E-08 9 0.2057049E-09 v, j, mj = 0 6 3 0 0.9126006E-07 1 0.9242083E-04 2 0.6708637E-03 3 0.3631263E-03 4 0.2131032E-04 5 0.4022159E-06 6 0.6189744E-07 7 0.6501411E-08 8 0.2732292E-08 9 0.9945403E-10 v, j, mj = 0 6 4 0 0.1522702E-12 1 0.1573705E-05 2 0.1250715E-03 3 0.1544641E-03 4 0.2716652E-04 5 0.9200823E-06 6 0.3255794E-07 7 0.1047023E-07 8 0.1738478E-08 9 0.2228544E-09 v, j, mj = 0 6 5 0 0.6773624E-14 1 0.1779263E-06 2 0.1012592E-04 3 0.3765942E-04 4 0.1621896E-04 5 0.1742841E-05 6 0.5571706E-07 7 0.8234643E-08 8 0.3168158E-08 9 0.1764250E-09 v, j, mj = 0 6 6 0 0.1750253E-07 1 0.2069029E-07 2 0.4179109E-06 3 0.5349633E-05 4 0.5506304E-05 5 0.1164855E-05 6 0.4590227E-07 7 0.4622368E-08 8 0.3129507E-08 9 0.1999752E-09 v, j, mj = 0 8 -8 0 0.3278763E-15 1 0.4040790E-09 2 0.2659052E-08 3 0.4615041E-08 4 0.8460706E-09 5 0.8662445E-09 6 0.2133456E-08 7 0.8363196E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.5510365E-16 1 0.6008425E-08 2 0.1927022E-07 3 0.3069111E-07 4 0.8447756E-08 5 0.8234220E-08 6 0.5168366E-08 7 0.1843465E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.2878348E-07 1 0.4887615E-07 2 0.1515153E-06 3 0.4233133E-06 4 0.1742279E-06 5 0.1138747E-07 6 0.1429827E-07 7 0.1443884E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1115469E-14 1 0.4419448E-06 2 0.6905645E-05 3 0.7950636E-05 4 0.1129719E-05 5 0.8054389E-07 6 0.2741276E-07 7 0.1534978E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.4926536E-13 1 0.3098764E-04 2 0.1410259E-03 3 0.5882902E-04 4 0.5446825E-05 5 0.6772158E-07 6 0.6415277E-08 7 0.9161019E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.3938487E-06 1 0.3158127E-03 2 0.9474491E-03 3 0.1075060E-03 4 0.1932813E-05 5 0.2698484E-06 6 0.1310679E-07 7 0.2129591E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.5534083E-12 1 0.1920069E-01 2 0.4133934E-02 3 0.1948178E-03 4 0.2297571E-04 5 0.2643031E-06 6 0.1060187E-06 7 0.1343389E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.2377958E-14 1 0.4853104E-02 2 0.3261731E-03 3 0.5456795E-04 4 0.1316742E-05 5 0.6803945E-07 6 0.2305466E-08 7 0.1764374E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.6849201E+00 1 0.1342463E+00 2 0.2964145E-01 3 0.1494410E-02 4 0.4956183E-04 5 0.4379532E-06 6 0.2933320E-07 7 0.2332445E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.1531391E-14 1 0.4853103E-02 2 0.3261732E-03 3 0.5456795E-04 4 0.1316744E-05 5 0.6803950E-07 6 0.2305462E-08 7 0.1764371E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.6110146E-12 1 0.1920069E-01 2 0.4133934E-02 3 0.1948178E-03 4 0.2297571E-04 5 0.2643032E-06 6 0.1060187E-06 7 0.1343389E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.3938004E-06 1 0.3158126E-03 2 0.9474491E-03 3 0.1075060E-03 4 0.1932812E-05 5 0.2698486E-06 6 0.1310678E-07 7 0.2129592E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.3332465E-13 1 0.3098765E-04 2 0.1410259E-03 3 0.5882902E-04 4 0.5446828E-05 5 0.6772151E-07 6 0.6415280E-08 7 0.9161018E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1872364E-14 1 0.4419386E-06 2 0.6905649E-05 3 0.7950636E-05 4 0.1129718E-05 5 0.8054391E-07 6 0.2741276E-07 7 0.1534978E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.2878349E-07 1 0.4887614E-07 2 0.1515136E-06 3 0.4233127E-06 4 0.1742272E-06 5 0.1138746E-07 6 0.1429827E-07 7 0.1443883E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1516391E-15 1 0.6008040E-08 2 0.1926969E-07 3 0.3069053E-07 4 0.8447720E-08 5 0.8234228E-08 6 0.5168368E-08 7 0.1843465E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.4619926E-15 1 0.4038047E-09 2 0.2658790E-08 3 0.4614948E-08 4 0.8461333E-09 5 0.8662578E-09 6 0.2133457E-08 7 0.8363197E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.2441336E-18 1 0.6124016E-12 2 0.4450775E-11 3 0.6220888E-11 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.8492230E-12 1 0.1232350E-11 2 0.1875983E-10 3 0.5159675E-11 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.1532337E-18 1 0.1215606E-10 2 0.1725084E-09 3 0.4189297E-10 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.1990256E-19 1 0.1560439E-09 2 0.1439236E-09 3 0.2716136E-10 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.2537233E-08 1 0.8353658E-08 2 0.2432681E-07 3 0.1696316E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.1446783E-18 1 0.1235367E-08 2 0.3041618E-08 3 0.2748799E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.1892902E-17 1 0.2515363E-06 2 0.2534380E-07 3 0.1576352E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.4153552E-08 1 0.2038253E-07 2 0.1134837E-06 3 0.6845529E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.5493227E-17 1 0.1303049E-06 2 0.1064777E-07 3 0.1503975E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.2454591E-17 1 0.1061040E-05 2 0.2851595E-06 3 0.9315175E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.1001909E-04 1 0.9024697E-05 2 0.1046156E-05 3 0.5039403E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.2483310E-17 1 0.1061040E-05 2 0.2851592E-06 3 0.9315177E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.5573673E-17 1 0.1303049E-06 2 0.1064776E-07 3 0.1503970E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.4153576E-08 1 0.2038253E-07 2 0.1134837E-06 3 0.6845530E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.1127728E-17 1 0.2515363E-06 2 0.2534380E-07 3 0.1576353E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.1992443E-18 1 0.1235374E-08 2 0.3041613E-08 3 0.2748805E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.2537235E-08 1 0.8353655E-08 2 0.2432681E-07 3 0.1696316E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.1771940E-19 1 0.1560448E-09 2 0.1439239E-09 3 0.2716144E-10 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.1903775E-18 1 0.1215608E-10 2 0.1725090E-09 3 0.4189296E-10 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.8492648E-12 1 0.1232369E-11 2 0.1875987E-10 3 0.5159703E-11 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.2356797E-18 1 0.6123991E-12 2 0.4450773E-11 3 0.6220877E-11 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.2300782E-05 1 0.2644900E-04 2 0.4633361E-04 3 0.7354586E-05 4 0.1326729E-05 5 0.1197109E-06 6 0.7610629E-08 7 0.6943509E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.1321001E-13 1 0.2529814E-04 2 0.8308671E-04 3 0.1943735E-04 4 0.1054989E-05 5 0.2120423E-07 6 0.1156953E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.8553567E-16 1 0.4853078E-04 2 0.3181366E-04 3 0.1604398E-04 4 0.1011451E-05 5 0.1706518E-07 6 0.7494115E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.9084255E-04 1 0.1487387E-03 2 0.4953512E-04 3 0.4235307E-05 4 0.7088219E-06 5 0.7092044E-07 6 0.2480756E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.4736930E-16 1 0.4853077E-04 2 0.3181366E-04 3 0.1604398E-04 4 0.1011451E-05 5 0.1706522E-07 6 0.7494116E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.1334165E-13 1 0.2529814E-04 2 0.8308671E-04 3 0.1943735E-04 4 0.1054988E-05 5 0.2120422E-07 6 0.1156953E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.6856689E-15 1 0.2234301E-08 2 0.3028000E-07 3 0.9605486E-08 4 0.8165545E-08 5 0.2346787E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.7076137E-09 1 0.3062530E-06 2 0.1293417E-05 3 0.2477214E-06 4 0.7802636E-08 5 0.1207590E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.1099164E-14 1 0.1035968E-04 2 0.9402162E-05 3 0.1708413E-06 4 0.9058029E-08 5 0.6910593E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.7083426E-16 1 0.7436252E-04 2 0.1519697E-04 3 0.1466910E-05 4 0.2456578E-07 5 0.7943959E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.2551634E-03 1 0.2131917E-03 2 0.3003366E-04 3 0.6232458E-06 4 0.3820601E-07 5 0.1962904E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.5563438E-16 1 0.7436253E-04 2 0.1519697E-04 3 0.1466910E-05 4 0.2456580E-07 5 0.7943955E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.4315506E-15 1 0.1035967E-04 2 0.9402162E-05 3 0.1708413E-06 4 0.9058021E-08 5 0.6910589E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.7074152E-09 1 0.3062526E-06 2 0.1293417E-05 3 0.2477215E-06 4 0.7802636E-08 5 0.1207592E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.8995228E-15 1 0.2234781E-08 2 0.3028043E-07 3 0.9605505E-08 4 0.8165541E-08 5 0.2346792E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.1955189E-10 1 0.8165471E-10 2 0.3954762E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.3213042E-19 1 0.2078978E-10 2 0.2447773E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.1257759E-18 1 0.1811473E-09 2 0.5639819E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.2406376E-09 1 0.1046376E-08 2 0.3115043E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.2324246E-18 1 0.1023489E-07 2 0.3299985E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.7648818E-19 1 0.6528842E-08 2 0.3880403E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.2418910E-06 1 0.1294804E-06 2 0.7354447E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.1049989E-18 1 0.6528841E-08 2 0.3880404E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.2117802E-18 1 0.1023488E-07 2 0.3299985E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.2406370E-09 1 0.1046376E-08 2 0.3115057E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.1292705E-18 1 0.1811460E-09 2 0.5639807E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.3114611E-19 1 0.2078971E-10 2 0.2447788E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.1955181E-10 1 0.8165485E-10 2 0.3954763E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9957919 average vibrational energy (ev) = 0.000796 average rotational energy (ev) = 0.473059 average diffraction energy (ev) = 0.003998 the reaction probability = 0.4208086D-02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.40129667D+01 trans energy = 0.37857143D+00 trans energy in z = 0.37857143D+00 total momentum = 0.10111041D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9913923E+00 0.4863338E-02 0.4586149E+00 1 0.4686409E-02 0.1873514E-01 0.8191715E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.2074974E-02 0 31 2 -2 0.1512753E-03 0 37 2 -1 0.1383453E-02 0 44 2 0 0.8589359E-02 0 50 2 1 0.1383453E-02 0 56 2 2 0.1512753E-03 0 21 4 -4 0.8403847E-05 0 26 4 -3 0.1808104E-03 0 32 4 -2 0.2008933E-02 0 38 4 -1 0.4072550E-02 0 45 4 0 0.1787804E-01 0 51 4 1 0.4072550E-02 0 57 4 2 0.2008933E-02 0 62 4 3 0.1808104E-03 0 67 4 4 0.8403836E-05 0 13 6 -6 0.7157993E-04 0 17 6 -5 0.3028960E-03 0 22 6 -4 0.1120660E-02 0 27 6 -3 0.3362156E-02 0 33 6 -2 0.8924852E-02 0 39 6 -1 0.4852623E-02 0 46 6 0 0.5857675E-01 0 52 6 1 0.4852623E-02 0 58 6 2 0.8924852E-02 0 63 6 3 0.3362156E-02 0 68 6 4 0.1120660E-02 0 72 6 5 0.3028959E-03 0 76 6 6 0.7157992E-04 0 7 8 -8 0.9407318E-07 0 10 8 -7 0.4944534E-06 0 14 8 -6 0.8649749E-05 0 18 8 -5 0.1326405E-03 0 23 8 -4 0.9538170E-03 0 28 8 -3 0.4429247E-02 0 34 8 -2 0.3911606E-01 0 40 8 -1 0.8483123E-02 0 47 8 0 0.7447853E+00 0 53 8 1 0.8483123E-02 0 59 8 2 0.3911607E-01 0 64 8 3 0.4429246E-02 0 69 8 4 0.9538171E-03 0 73 8 5 0.1326405E-03 0 77 8 6 0.8649742E-05 0 80 8 7 0.4944475E-06 0 83 8 8 0.9407078E-07 0 3 10 -10 0.7047238E-10 0 5 10 -9 0.4338640E-09 0 8 10 -8 0.6569153E-09 0 11 10 -7 0.4076532E-08 0 15 10 -6 0.5731155E-07 0 19 10 -5 0.1112080E-07 0 24 10 -4 0.1805231E-06 0 29 10 -3 0.5089750E-06 0 35 10 -2 0.8548740E-06 0 41 10 -1 0.2227917E-04 0 48 10 0 0.3114080E-03 0 54 10 1 0.2227917E-04 0 60 10 2 0.8548740E-06 0 65 10 3 0.5089747E-06 0 70 10 4 0.1805232E-06 0 74 10 5 0.1112082E-07 0 78 10 6 0.5731159E-07 0 81 10 7 0.4076541E-08 0 84 10 8 0.6569234E-09 0 86 10 9 0.4338713E-09 0 88 10 10 0.7047219E-10 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.2090269E-03 1 31 2 -2 0.1892575E-03 1 37 2 -1 0.7170561E-03 1 44 2 0 0.7700619E-03 1 50 2 1 0.7170561E-03 1 56 2 2 0.1892574E-03 1 21 4 -4 0.3729303E-05 1 26 4 -3 0.5320212E-04 1 32 4 -2 0.2911952E-03 1 38 4 -1 0.2442799E-03 1 45 4 0 0.6993089E-03 1 51 4 1 0.2442799E-03 1 57 4 2 0.2911952E-03 1 62 4 3 0.5320211E-04 1 67 4 4 0.3729320E-05 1 13 6 -6 0.9847427E-09 1 17 6 -5 0.2830909E-08 1 22 6 -4 0.6728271E-08 1 27 6 -3 0.4880770E-08 1 33 6 -2 0.1446580E-06 1 39 6 -1 0.2833957E-06 1 46 6 0 0.9684598E-05 1 52 6 1 0.2833957E-06 1 58 6 2 0.1446579E-06 1 63 6 3 0.4880774E-08 1 68 6 4 0.6728232E-08 1 72 6 5 0.2830911E-08 1 76 6 6 0.9847413E-09 1 7 8 -8 0.0000000E+00 1 10 8 -7 0.0000000E+00 1 14 8 -6 0.0000000E+00 1 18 8 -5 0.0000000E+00 1 23 8 -4 0.0000000E+00 1 28 8 -3 0.0000000E+00 1 34 8 -2 0.0000000E+00 1 40 8 -1 0.0000000E+00 1 47 8 0 0.0000000E+00 1 53 8 1 0.0000000E+00 1 59 8 2 0.0000000E+00 1 64 8 3 0.0000000E+00 1 69 8 4 0.0000000E+00 1 73 8 5 0.0000000E+00 1 77 8 6 0.0000000E+00 1 80 8 7 0.0000000E+00 1 83 8 8 0.0000000E+00 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.1720708E-03 1 0.2593216E-03 2 0.1170337E-02 3 0.4345501E-03 4 0.3573891E-04 5 0.2591756E-05 6 0.2586630E-06 7 0.6544445E-07 8 0.3768138E-07 9 0.1931174E-08 v, j, mj = 0 2 -2 0 0.1309738E-12 1 0.3385413E-04 2 0.8601143E-04 3 0.2800986E-04 4 0.2837161E-05 5 0.2446962E-06 6 0.1765726E-06 7 0.1119684E-06 8 0.2808793E-07 9 0.1366232E-08 v, j, mj = 0 2 -1 0 0.3743422E-14 1 0.7900655E-03 2 0.2755444E-03 3 0.2902142E-03 4 0.2406987E-04 5 0.3341753E-05 6 0.1217838E-06 7 0.7916588E-07 8 0.1429032E-07 9 0.1694866E-08 v, j, mj = 0 2 0 0 0.2063214E-03 1 0.1798065E-02 2 0.4569549E-02 3 0.1882658E-02 4 0.1301162E-03 5 0.2092905E-05 6 0.4552945E-06 7 0.7147359E-07 8 0.2526821E-07 9 0.4869658E-08 v, j, mj = 0 2 1 0 0.5258727E-14 1 0.7900655E-03 2 0.2755444E-03 3 0.2902142E-03 4 0.2406988E-04 5 0.3341765E-05 6 0.1217804E-06 7 0.7916828E-07 8 0.1429086E-07 9 0.1694811E-08 v, j, mj = 0 2 2 0 0.1489434E-12 1 0.3385415E-04 2 0.8601141E-04 3 0.2800985E-04 4 0.2837162E-05 5 0.2447002E-06 6 0.1765738E-06 7 0.1119670E-06 8 0.2808811E-07 9 0.1366223E-08 v, j, mj = 0 4 -4 0 0.4480389E-13 1 0.1828830E-06 2 0.4389379E-05 3 0.1772983E-05 4 0.1010324E-05 5 0.6435344E-06 6 0.3520319E-06 7 0.4776455E-07 8 0.3902999E-08 9 0.1044258E-08 v, j, mj = 0 4 -3 0 0.3635237E-07 1 0.2271762E-04 2 0.1054593E-03 3 0.3390010E-04 4 0.1550526E-04 5 0.2805551E-05 6 0.3717488E-06 7 0.1160053E-07 8 0.1772885E-08 9 0.1139512E-08 v, j, mj = 0 4 -2 0 0.6272541E-12 1 0.5975350E-03 2 0.1140154E-02 3 0.2230100E-03 4 0.4724801E-04 5 0.5297406E-06 6 0.4186802E-06 7 0.3173132E-07 8 0.5421254E-08 9 0.6072607E-09 v, j, mj = 0 4 -1 0 0.1974292E-13 1 0.1960309E-02 2 0.9433779E-03 3 0.1026500E-02 4 0.1403940E-03 5 0.1766022E-05 6 0.1786679E-06 7 0.2084452E-07 8 0.2769413E-08 9 0.5068521E-09 v, j, mj = 0 4 0 0 0.9688987E-03 1 0.7415833E-02 2 0.5992708E-02 3 0.3343890E-02 4 0.1544474E-03 5 0.1795773E-05 6 0.3965970E-06 7 0.6005874E-07 8 0.8923953E-08 9 0.8931888E-09 v, j, mj = 0 4 1 0 0.3532083E-13 1 0.1960309E-02 2 0.9433780E-03 3 0.1026500E-02 4 0.1403940E-03 5 0.1766014E-05 6 0.1786919E-06 7 0.2084528E-07 8 0.2769168E-08 9 0.5068400E-09 v, j, mj = 0 4 2 0 0.6605240E-12 1 0.5975350E-03 2 0.1140154E-02 3 0.2230101E-03 4 0.4724800E-04 5 0.5297277E-06 6 0.4186719E-06 7 0.3173226E-07 8 0.5421417E-08 9 0.6072573E-09 v, j, mj = 0 4 3 0 0.3632576E-07 1 0.2271763E-04 2 0.1054593E-03 3 0.3390011E-04 4 0.1550526E-04 5 0.2805548E-05 6 0.3717411E-06 7 0.1159956E-07 8 0.1772891E-08 9 0.1139513E-08 v, j, mj = 0 4 4 0 0.4587489E-13 1 0.1828841E-06 2 0.4389372E-05 3 0.1772983E-05 4 0.1010322E-05 5 0.6435333E-06 6 0.3520292E-06 7 0.4776453E-07 8 0.3902938E-08 9 0.1044260E-08 v, j, mj = 0 6 -6 0 0.1743275E-06 1 0.1147884E-06 2 0.3159993E-05 3 0.3334913E-04 4 0.2777767E-04 5 0.6526763E-05 6 0.4624712E-06 7 0.1217938E-07 8 0.2016073E-08 9 0.5871729E-09 v, j, mj = 0 6 -5 0 0.3721471E-13 1 0.1206764E-05 2 0.5607836E-04 3 0.1805764E-03 4 0.5922044E-04 5 0.5581447E-05 6 0.2211199E-06 7 0.9331787E-08 8 0.1574175E-08 9 0.5775172E-09 v, j, mj = 0 6 -4 0 0.8401953E-12 1 0.6094778E-05 2 0.5357045E-03 3 0.5150609E-03 4 0.6299751E-04 5 0.7447702E-06 6 0.4189168E-07 7 0.1188453E-07 8 0.3384175E-08 9 0.4709362E-09 v, j, mj = 0 6 -3 0 0.2766508E-06 1 0.3384505E-03 2 0.2095660E-02 3 0.8797263E-03 4 0.4633001E-04 5 0.1631281E-05 6 0.7590995E-07 7 0.2924422E-08 8 0.1494357E-08 9 0.4142501E-09 v, j, mj = 0 6 -2 0 0.5924642E-11 1 0.4233223E-02 2 0.4015092E-02 3 0.6021346E-03 4 0.7347672E-04 5 0.8706878E-06 6 0.4569505E-07 7 0.7073879E-08 8 0.2856045E-08 9 0.3896242E-09 v, j, mj = 0 6 -1 0 0.8910614E-14 1 0.3404756E-02 2 0.4814894E-03 3 0.8101601E-03 4 0.1540566E-03 5 0.2130682E-05 6 0.2083559E-07 7 0.7646031E-08 8 0.8838530E-09 9 0.1027474E-08 v, j, mj = 0 6 0 0 0.2920558E-01 1 0.2268723E-01 2 0.4922108E-02 3 0.1627992E-02 4 0.1307642E-03 5 0.2957741E-05 6 0.1080453E-06 7 0.5560367E-08 8 0.6977184E-08 9 0.6940871E-09 v, j, mj = 0 6 1 0 0.4244970E-13 1 0.3404757E-02 2 0.4814888E-03 3 0.8101597E-03 4 0.1540565E-03 5 0.2130688E-05 6 0.2083183E-07 7 0.7646359E-08 8 0.8838581E-09 9 0.1027474E-08 v, j, mj = 0 6 2 0 0.6723565E-11 1 0.4233223E-02 2 0.4015092E-02 3 0.6021344E-03 4 0.7347670E-04 5 0.8706861E-06 6 0.4569595E-07 7 0.7074116E-08 8 0.2856036E-08 9 0.3896260E-09 v, j, mj = 0 6 3 0 0.2766954E-06 1 0.3384505E-03 2 0.2095660E-02 3 0.8797262E-03 4 0.4633001E-04 5 0.1631282E-05 6 0.7590684E-07 7 0.2924166E-08 8 0.1494375E-08 9 0.4142499E-09 v, j, mj = 0 6 4 0 0.8010219E-12 1 0.6094701E-05 2 0.5357046E-03 3 0.5150609E-03 4 0.6299750E-04 5 0.7447771E-06 6 0.4189311E-07 7 0.1188432E-07 8 0.3384166E-08 9 0.4709364E-09 v, j, mj = 0 6 5 0 0.4759745E-13 1 0.1206723E-05 2 0.5607835E-04 3 0.1805764E-03 4 0.5922044E-04 5 0.5581445E-05 6 0.2211211E-06 7 0.9331813E-08 8 0.1574179E-08 9 0.5775177E-09 v, j, mj = 0 6 6 0 0.1743279E-06 1 0.1147860E-06 2 0.3159984E-05 3 0.3334914E-04 4 0.2777767E-04 5 0.6526764E-05 6 0.4624708E-06 7 0.1217949E-07 8 0.2016077E-08 9 0.5871722E-09 v, j, mj = 0 8 -8 0 0.4952197E-14 1 0.9635325E-08 2 0.1599556E-07 3 0.3901020E-07 4 0.2131230E-07 5 0.3380155E-08 6 0.2131273E-08 7 0.2608362E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.5681566E-15 1 0.2915127E-07 2 0.6757654E-07 3 0.2699275E-06 4 0.1019429E-06 5 0.1643565E-07 6 0.4699079E-08 7 0.4720560E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.7000373E-07 1 0.2240125E-06 2 0.9105749E-06 3 0.5242711E-05 4 0.2065728E-05 5 0.1145201E-06 6 0.1332738E-07 7 0.8870729E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1921065E-13 1 0.4542355E-06 2 0.5075238E-04 3 0.6982507E-04 4 0.1137357E-04 5 0.2077872E-06 6 0.2187247E-07 7 0.5610462E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.7486240E-12 1 0.7713483E-04 2 0.5854369E-03 3 0.2762005E-03 4 0.1496028E-04 5 0.6037400E-07 6 0.2260065E-07 7 0.1442559E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.9345779E-06 1 0.1016098E-02 2 0.3254467E-02 3 0.1521527E-03 4 0.5137291E-05 5 0.4393292E-06 6 0.1239519E-07 7 0.5430922E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.7138269E-11 1 0.3541304E-01 2 0.3369868E-02 3 0.2980672E-03 4 0.3465256E-04 5 0.3867598E-06 6 0.4033744E-07 7 0.1262412E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.1907677E-13 1 0.8236532E-02 2 0.1555683E-03 3 0.8729775E-04 4 0.3483212E-05 5 0.2338697E-06 6 0.5232494E-08 7 0.2634107E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.6955708E+00 1 0.2270362E-01 2 0.2561964E-01 3 0.8560077E-03 4 0.3442261E-04 5 0.7616947E-06 6 0.2739210E-07 7 0.3816868E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.6514454E-14 1 0.8236532E-02 2 0.1555687E-03 3 0.8729773E-04 4 0.3483220E-05 5 0.2338694E-06 6 0.5232451E-08 7 0.2634105E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.7925176E-11 1 0.3541304E-01 2 0.3369868E-02 3 0.2980672E-03 4 0.3465256E-04 5 0.3867609E-06 6 0.4033712E-07 7 0.1262412E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.9343264E-06 1 0.1016097E-02 2 0.3254467E-02 3 0.1521527E-03 4 0.5137287E-05 5 0.4393306E-06 6 0.1239513E-07 7 0.5430926E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.5584004E-12 1 0.7713487E-04 2 0.5854370E-03 3 0.2762005E-03 4 0.1496031E-04 5 0.6037436E-07 6 0.2260068E-07 7 0.1442562E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.3023256E-13 1 0.4541967E-06 2 0.5075239E-04 3 0.6982507E-04 4 0.1137357E-04 5 0.2077874E-06 6 0.2187248E-07 7 0.5610464E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.7000391E-07 1 0.2240127E-06 2 0.9105694E-06 3 0.5242712E-05 4 0.2065726E-05 5 0.1145199E-06 6 0.1332738E-07 7 0.8870729E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.2228969E-14 1 0.2914980E-07 2 0.6757514E-07 3 0.2699262E-06 4 0.1019413E-06 5 0.1643539E-07 6 0.4699087E-08 7 0.4720566E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.5743691E-14 1 0.9635023E-08 2 0.1599495E-07 3 0.3900885E-07 4 0.2131210E-07 5 0.3380215E-08 6 0.2131277E-08 7 0.2608366E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.1381385E-18 1 0.1391211E-11 2 0.7801880E-11 3 0.2508349E-10 4 0.3619580E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.1506431E-10 1 0.7713567E-10 2 0.1583404E-09 3 0.8540390E-10 4 0.9791972E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.3575340E-17 1 0.3022198E-09 2 0.1427287E-09 3 0.1882353E-09 4 0.2373143E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.4976781E-17 1 0.1727976E-08 2 0.1739214E-08 3 0.4250525E-09 4 0.1842893E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.2526400E-07 1 0.1841085E-07 2 0.1230213E-07 3 0.8147241E-09 4 0.5198369E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.2179274E-16 1 0.6185327E-08 2 0.3173495E-08 3 0.1527393E-08 4 0.2345875E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.4785155E-15 1 0.1547718E-08 2 0.1683755E-06 3 0.9692254E-08 4 0.9075836E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.1252534E-07 1 0.2081669E-06 2 0.1995070E-06 3 0.8026352E-07 4 0.8512212E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.1299345E-14 1 0.2887020E-06 2 0.5286313E-06 3 0.3525388E-07 4 0.2286745E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.3450429E-16 1 0.2037840E-04 2 0.1682895E-05 3 0.1755583E-06 4 0.4232225E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.1686201E-03 1 0.1370161E-03 2 0.5210728E-05 3 0.5243395E-06 4 0.3668928E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.5254034E-17 1 0.2037840E-04 2 0.1682895E-05 3 0.1755583E-06 4 0.4232231E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.1350319E-14 1 0.2887021E-06 2 0.5286311E-06 3 0.3525408E-07 4 0.2286743E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.1252603E-07 1 0.2081661E-06 2 0.1995067E-06 3 0.8026363E-07 4 0.8512199E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.2295105E-15 1 0.1547776E-08 2 0.1683756E-06 3 0.9692271E-08 4 0.9075821E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.2823185E-16 1 0.6185328E-08 2 0.3173518E-08 3 0.1527385E-08 4 0.2345880E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.2526401E-07 1 0.1841085E-07 2 0.1230217E-07 3 0.8147288E-09 4 0.5198373E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.5317656E-17 1 0.1727981E-08 2 0.1739218E-08 3 0.4250519E-09 4 0.1842901E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.3404441E-17 1 0.3022284E-09 2 0.1427270E-09 3 0.1882365E-09 4 0.2373161E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.1507129E-10 1 0.7713829E-10 2 0.1583381E-09 3 0.8540437E-10 4 0.9791927E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.2698976E-18 1 0.1390840E-11 2 0.7801951E-11 3 0.2508361E-10 4 0.3619579E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.9786180E-05 1 0.7106877E-04 2 0.1236665E-03 3 0.3225776E-05 4 0.6496566E-06 5 0.6006789E-06 6 0.2808866E-07 7 0.1206096E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.7596656E-13 1 0.2066827E-04 2 0.1117124E-03 3 0.5079109E-04 4 0.5855654E-05 5 0.2271498E-06 6 0.2836897E-08 7 0.1088412E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.1897504E-14 1 0.3003772E-03 2 0.3201196E-03 3 0.9142749E-04 4 0.5024444E-05 5 0.1038951E-06 6 0.3325337E-08 7 0.7500464E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.2431153E-03 1 0.3558846E-03 2 0.1561090E-03 3 0.1236092E-04 4 0.2184293E-05 5 0.3972838E-06 6 0.9528303E-08 7 0.8669340E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.8777683E-15 1 0.3003772E-03 2 0.3201197E-03 3 0.9142748E-04 4 0.5024440E-05 5 0.1038953E-06 6 0.3325333E-08 7 0.7500397E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.8480745E-13 1 0.2066826E-04 2 0.1117123E-03 3 0.5079104E-04 4 0.5855651E-05 5 0.2271499E-06 6 0.2836882E-08 7 0.1088406E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.8758163E-14 1 0.4907106E-07 2 0.2027686E-05 3 0.1577730E-05 4 0.7251176E-07 5 0.2290064E-08 6 0.1497198E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.8078717E-08 1 0.5764749E-05 2 0.3595134E-04 3 0.1122856E-04 4 0.2380710E-06 5 0.1131263E-07 6 0.1685980E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.3429124E-13 1 0.1196663E-03 2 0.1601056E-03 3 0.1133768E-04 4 0.8429927E-07 5 0.1275238E-08 6 0.5109207E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.1864160E-14 1 0.2134792E-03 2 0.1233393E-04 3 0.1775168E-04 4 0.7084743E-06 5 0.6519979E-08 6 0.6638220E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.4868197E-03 1 0.1440452E-03 2 0.6746922E-04 3 0.5284657E-06 4 0.3814728E-06 5 0.6487073E-07 6 0.5067274E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.1089040E-14 1 0.2134792E-03 2 0.1233393E-04 3 0.1775168E-04 4 0.7084745E-06 5 0.6519985E-08 6 0.6638250E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.1973154E-13 1 0.1196663E-03 2 0.1601056E-03 3 0.1133768E-04 4 0.8429929E-07 5 0.1275241E-08 6 0.5109218E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.8072423E-08 1 0.5764747E-05 2 0.3595133E-04 3 0.1122856E-04 4 0.2380711E-06 5 0.1131263E-07 6 0.1685971E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.9331142E-14 1 0.4907885E-07 2 0.2027694E-05 3 0.1577730E-05 4 0.7251179E-07 5 0.2290067E-08 6 0.1497190E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.2362395E-09 1 0.7033120E-10 2 0.3573915E-09 3 0.3207804E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.3846607E-18 1 0.3717058E-09 2 0.2092818E-08 3 0.3663853E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.1316533E-17 1 0.3534347E-08 2 0.2692564E-08 3 0.5013591E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.8852184E-10 1 0.8555301E-09 2 0.1251099E-08 3 0.2685619E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.1855691E-16 1 0.4340076E-07 2 0.8572431E-07 3 0.1553291E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.8018625E-17 1 0.1733255E-06 2 0.9511484E-07 3 0.1495529E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.5919889E-05 1 0.3617954E-05 2 0.5567031E-07 3 0.9108504E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.7179000E-17 1 0.1733255E-06 2 0.9511491E-07 3 0.1495527E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.1013058E-17 1 0.4340067E-07 2 0.8572426E-07 3 0.1553292E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.8849754E-10 1 0.8555869E-09 2 0.1251071E-08 3 0.2685618E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.1017704E-17 1 0.3534300E-08 2 0.2692571E-08 3 0.5013614E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.1378598E-18 1 0.3717053E-09 2 0.2092820E-08 3 0.3663861E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.2362400E-09 1 0.7033025E-10 2 0.3573903E-09 3 0.3207807E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9960787 average vibrational energy (ev) = 0.002397 average rotational energy (ev) = 0.456843 average diffraction energy (ev) = 0.004929 the reaction probability = 0.3921298D-02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.39558238D+01 trans energy = 0.43571429D+00 trans energy in z = 0.43571429D+00 total momentum = 0.10847330D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9899490E+00 0.7961068E-02 0.4422667E+00 1 0.1010902E-01 0.2334504E-01 0.1056586E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.3512878E-02 0 31 2 -2 0.2191514E-03 0 37 2 -1 0.2697671E-02 0 44 2 0 0.1283024E-01 0 50 2 1 0.2697671E-02 0 56 2 2 0.2191514E-03 0 21 4 -4 0.5308015E-04 0 26 4 -3 0.5306659E-03 0 32 4 -2 0.3577833E-02 0 38 4 -1 0.5939482E-02 0 45 4 0 0.2355390E-01 0 51 4 1 0.5939482E-02 0 57 4 2 0.3577833E-02 0 62 4 3 0.5306660E-03 0 67 4 4 0.5308010E-04 0 13 6 -6 0.2268757E-03 0 17 6 -5 0.9249744E-03 0 22 6 -4 0.2820068E-02 0 27 6 -3 0.6958257E-02 0 33 6 -2 0.1503575E-01 0 39 6 -1 0.6859459E-02 0 46 6 0 0.7043784E-01 0 52 6 1 0.6859458E-02 0 58 6 2 0.1503575E-01 0 63 6 3 0.6958256E-02 0 68 6 4 0.2820068E-02 0 72 6 5 0.9249742E-03 0 76 6 6 0.2268757E-03 0 7 8 -8 0.6491650E-06 0 10 8 -7 0.8527121E-05 0 14 8 -6 0.9146718E-04 0 18 8 -5 0.7779562E-03 0 23 8 -4 0.3201145E-02 0 28 8 -3 0.1081931E-01 0 34 8 -2 0.5712167E-01 0 40 8 -1 0.1198802E-01 0 47 8 0 0.6175158E+00 0 53 8 1 0.1198802E-01 0 59 8 2 0.5712167E-01 0 64 8 3 0.1081931E-01 0 69 8 4 0.3201145E-02 0 73 8 5 0.7779561E-03 0 77 8 6 0.9146717E-04 0 80 8 7 0.8527112E-05 0 83 8 8 0.6491510E-06 0 3 10 -10 0.5109831E-09 0 5 10 -9 0.2205895E-08 0 8 10 -8 0.3196703E-08 0 11 10 -7 0.1296276E-07 0 15 10 -6 0.9916556E-07 0 19 10 -5 0.8069442E-07 0 24 10 -4 0.1122922E-05 0 29 10 -3 0.4762336E-05 0 35 10 -2 0.8008269E-05 0 41 10 -1 0.1845673E-03 0 48 10 0 0.1996994E-02 0 54 10 1 0.1845673E-03 0 60 10 2 0.8008271E-05 0 65 10 3 0.4762343E-05 0 70 10 4 0.1122926E-05 0 74 10 5 0.8069627E-07 0 78 10 6 0.9916597E-07 0 81 10 7 0.1296290E-07 0 84 10 8 0.3196718E-08 0 86 10 9 0.2206069E-08 0 88 10 10 0.5110063E-09 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.3075834E-03 1 31 2 -2 0.8286501E-04 1 37 2 -1 0.1106292E-02 1 44 2 0 0.1125560E-02 1 50 2 1 0.1106292E-02 1 56 2 2 0.8286497E-04 1 21 4 -4 0.3878953E-03 1 26 4 -3 0.5439716E-03 1 32 4 -2 0.9111831E-03 1 38 4 -1 0.7065583E-03 1 45 4 0 0.1084308E-02 1 51 4 1 0.7065583E-03 1 57 4 2 0.9111830E-03 1 62 4 3 0.5439717E-03 1 67 4 4 0.3878953E-03 1 13 6 -6 0.9177100E-08 1 17 6 -5 0.1101930E-07 1 22 6 -4 0.4876964E-07 1 27 6 -3 0.7289759E-06 1 33 6 -2 0.5266133E-05 1 39 6 -1 0.5065820E-05 1 46 6 0 0.9177761E-04 1 52 6 1 0.5065822E-05 1 58 6 2 0.5266134E-05 1 63 6 3 0.7289774E-06 1 68 6 4 0.4876984E-07 1 72 6 5 0.1101923E-07 1 76 6 6 0.9177046E-08 1 7 8 -8 0.0000000E+00 1 10 8 -7 0.0000000E+00 1 14 8 -6 0.0000000E+00 1 18 8 -5 0.0000000E+00 1 23 8 -4 0.0000000E+00 1 28 8 -3 0.0000000E+00 1 34 8 -2 0.0000000E+00 1 40 8 -1 0.0000000E+00 1 47 8 0 0.0000000E+00 1 53 8 1 0.0000000E+00 1 59 8 2 0.0000000E+00 1 64 8 3 0.0000000E+00 1 69 8 4 0.0000000E+00 1 73 8 5 0.0000000E+00 1 77 8 6 0.0000000E+00 1 80 8 7 0.0000000E+00 1 83 8 8 0.0000000E+00 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.5516972E-03 1 0.2896290E-03 2 0.1497462E-02 3 0.9684397E-03 4 0.2007972E-03 5 0.3046125E-05 6 0.1260407E-05 7 0.3196172E-06 8 0.1931911E-06 9 0.3380505E-07 v, j, mj = 0 2 -2 0 0.5563802E-12 1 0.5247841E-04 2 0.1359873E-03 3 0.2273172E-04 4 0.5062916E-05 5 0.1296726E-05 6 0.7278273E-06 7 0.6214116E-06 8 0.2256780E-06 9 0.1938525E-07 v, j, mj = 0 2 -1 0 0.4324523E-13 1 0.1723166E-02 2 0.4155068E-03 3 0.4484677E-03 4 0.9895866E-04 5 0.1031362E-04 6 0.1013440E-05 7 0.1901513E-06 8 0.4899990E-07 9 0.4942222E-08 v, j, mj = 0 2 0 0 0.1072569E-02 1 0.1406337E-02 2 0.5862121E-02 3 0.3880776E-02 4 0.5913559E-03 5 0.1627770E-04 6 0.5239960E-06 7 0.1357917E-06 8 0.1240955E-06 9 0.2068176E-07 v, j, mj = 0 2 1 0 0.4276940E-13 1 0.1723166E-02 2 0.4155068E-03 3 0.4484677E-03 4 0.9895866E-04 5 0.1031361E-04 6 0.1013418E-05 7 0.1901531E-06 8 0.4900209E-07 9 0.4942036E-08 v, j, mj = 0 2 2 0 0.6966928E-12 1 0.5247842E-04 2 0.1359873E-03 3 0.2273172E-04 4 0.5062895E-05 5 0.1296731E-05 6 0.7278288E-06 7 0.6214111E-06 8 0.2256787E-06 9 0.1938540E-07 v, j, mj = 0 4 -4 0 0.3129881E-12 1 0.7907305E-06 2 0.2898872E-04 3 0.1028408E-04 4 0.8613446E-05 5 0.2706483E-05 6 0.1221837E-05 7 0.4155255E-06 8 0.5773474E-07 9 0.1585920E-08 v, j, mj = 0 4 -3 0 0.6567318E-07 1 0.6219396E-04 2 0.3806981E-03 3 0.5325140E-04 4 0.2912067E-04 5 0.3880027E-05 6 0.1364098E-05 7 0.8131877E-07 8 0.8737626E-08 9 0.1952432E-08 v, j, mj = 0 4 -2 0 0.1525170E-11 1 0.1089158E-02 2 0.2273887E-02 3 0.1676839E-03 4 0.4141777E-04 5 0.4217665E-05 6 0.1284059E-05 7 0.1700887E-06 8 0.1304749E-07 9 0.1496661E-08 v, j, mj = 0 4 -1 0 0.1108840E-12 1 0.3111041E-02 2 0.1010917E-02 3 0.1421313E-02 4 0.3735715E-03 5 0.2228148E-04 6 0.3130836E-06 7 0.3434374E-07 8 0.9115336E-08 9 0.7088384E-09 v, j, mj = 0 4 0 0 0.2631136E-03 1 0.7409787E-02 2 0.9096551E-02 3 0.6431543E-02 4 0.3417570E-03 5 0.1048734E-04 6 0.5103223E-06 7 0.1213190E-06 8 0.2281842E-07 9 0.2183901E-08 v, j, mj = 0 4 1 0 0.1818098E-12 1 0.3111042E-02 2 0.1010917E-02 3 0.1421313E-02 4 0.3735715E-03 5 0.2228145E-04 6 0.3131267E-06 7 0.3434113E-07 8 0.9115691E-08 9 0.7088469E-09 v, j, mj = 0 4 2 0 0.1599485E-11 1 0.1089158E-02 2 0.2273887E-02 3 0.1676841E-03 4 0.4141775E-04 5 0.4217619E-05 6 0.1284043E-05 7 0.1700875E-06 8 0.1304788E-07 9 0.1496714E-08 v, j, mj = 0 4 3 0 0.6563092E-07 1 0.6219399E-04 2 0.3806981E-03 3 0.5325147E-04 4 0.2912069E-04 5 0.3880026E-05 6 0.1364084E-05 7 0.8131960E-07 8 0.8737679E-08 9 0.1952473E-08 v, j, mj = 0 4 4 0 0.3521618E-12 1 0.7906779E-06 2 0.2898872E-04 3 0.1028410E-04 4 0.8613439E-05 5 0.2706484E-05 6 0.1221824E-05 7 0.4155263E-06 8 0.5773520E-07 9 0.1585906E-08 v, j, mj = 0 6 -6 0 0.7046934E-06 1 0.3951713E-06 2 0.1259847E-04 3 0.1228387E-03 4 0.7008360E-04 5 0.1775406E-04 6 0.2397562E-05 7 0.1010213E-06 8 0.1924157E-08 9 0.4711466E-09 v, j, mj = 0 6 -5 0 0.3386692E-13 1 0.4905892E-05 2 0.2176675E-03 3 0.5736815E-03 4 0.1189875E-03 5 0.9074914E-05 6 0.6145673E-06 7 0.3911426E-07 8 0.2637062E-08 9 0.6734434E-09 v, j, mj = 0 6 -4 0 0.3027540E-11 1 0.1904298E-04 2 0.1602504E-02 3 0.1112557E-02 4 0.8426555E-04 5 0.1436668E-05 6 0.2408933E-06 7 0.1685035E-07 8 0.2501081E-08 9 0.7110808E-09 v, j, mj = 0 6 -3 0 0.8008513E-06 1 0.8467824E-03 2 0.4386078E-02 3 0.1617066E-02 4 0.1044278E-03 5 0.2800522E-05 6 0.2838184E-06 7 0.1607956E-07 8 0.1363880E-08 9 0.4505150E-09 v, j, mj = 0 6 -2 0 0.1938281E-10 1 0.6853950E-02 2 0.6518553E-02 3 0.1491794E-02 4 0.1670247E-03 5 0.4350565E-05 6 0.7246622E-07 7 0.4653078E-08 8 0.2037622E-08 9 0.1741406E-08 v, j, mj = 0 6 -1 0 0.3167026E-13 1 0.3330287E-02 2 0.6826804E-03 3 0.2293326E-02 4 0.5518135E-03 5 0.1227408E-05 6 0.1158955E-06 7 0.6240956E-08 8 0.2155660E-08 9 0.7680721E-09 v, j, mj = 0 6 0 0 0.2040156E-01 1 0.3229413E-01 2 0.1249371E-01 3 0.4666323E-02 4 0.5761833E-03 5 0.5715089E-05 6 0.1940107E-06 7 0.1816228E-07 8 0.4658154E-08 9 0.2130798E-08 v, j, mj = 0 6 1 0 0.1508951E-12 1 0.3330288E-02 2 0.6826793E-03 3 0.2293325E-02 4 0.5518131E-03 5 0.1227412E-05 6 0.1158895E-06 7 0.6243492E-08 8 0.2155747E-08 9 0.7680714E-09 v, j, mj = 0 6 2 0 0.2179419E-10 1 0.6853950E-02 2 0.6518553E-02 3 0.1491793E-02 4 0.1670246E-03 5 0.4350536E-05 6 0.7247492E-07 7 0.4653187E-08 8 0.2037707E-08 9 0.1741412E-08 v, j, mj = 0 6 3 0 0.8009075E-06 1 0.8467823E-03 2 0.4386077E-02 3 0.1617065E-02 4 0.1044279E-03 5 0.2800541E-05 6 0.2838166E-06 7 0.1608004E-07 8 0.1363969E-08 9 0.4505127E-09 v, j, mj = 0 6 4 0 0.2899877E-11 1 0.1904289E-04 2 0.1602504E-02 3 0.1112557E-02 4 0.8426556E-04 5 0.1436694E-05 6 0.2408990E-06 7 0.1684987E-07 8 0.2501157E-08 9 0.7110797E-09 v, j, mj = 0 6 5 0 0.5696996E-13 1 0.4905743E-05 2 0.2176675E-03 3 0.5736815E-03 4 0.1189875E-03 5 0.9074904E-05 6 0.6145664E-06 7 0.3911422E-07 8 0.2637063E-08 9 0.6734417E-09 v, j, mj = 0 6 6 0 0.7046929E-06 1 0.3951669E-06 2 0.1259840E-04 3 0.1228388E-03 4 0.7008361E-04 5 0.1775407E-04 6 0.2397560E-05 7 0.1010222E-06 8 0.1924203E-08 9 0.4711466E-09 v, j, mj = 0 8 -8 0 0.9748704E-13 1 0.8842081E-07 2 0.5729328E-07 3 0.2398912E-06 4 0.2154986E-06 5 0.4418182E-07 6 0.1638180E-08 7 0.1502772E-08 8 0.7382509E-09 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.6148037E-14 1 0.8016010E-07 2 0.3311642E-06 3 0.4216617E-05 4 0.3432630E-05 5 0.4392741E-06 6 0.1613078E-07 7 0.6151994E-08 8 0.4992761E-08 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.2654534E-06 1 0.8543439E-06 2 0.8233222E-05 3 0.5690519E-04 4 0.2350601E-04 5 0.1659358E-05 6 0.3741253E-07 7 0.5774603E-08 8 0.4191970E-09 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1658050E-12 1 0.6450822E-06 2 0.3038962E-03 3 0.4109795E-03 4 0.6062890E-04 5 0.1777752E-05 6 0.2034576E-07 7 0.7463717E-08 8 0.9346059E-09 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.6208821E-11 1 0.2132891E-03 2 0.2173679E-02 3 0.8008753E-03 4 0.1236639E-04 5 0.8763712E-06 6 0.5717910E-07 7 0.1312836E-08 8 0.3625206E-09 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.2271074E-05 1 0.2754999E-02 2 0.7979303E-02 3 0.4311834E-04 4 0.3879158E-04 5 0.7963953E-06 6 0.2074779E-07 7 0.4135150E-08 8 0.5005477E-08 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.4871157E-10 1 0.5518728E-01 2 0.1235529E-02 3 0.6813600E-03 4 0.1694348E-04 5 0.5055414E-06 6 0.3681682E-07 7 0.9344871E-08 8 0.7287948E-09 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.8079368E-13 1 0.1067548E-01 2 0.1228975E-02 3 0.6312110E-04 4 0.2029644E-04 5 0.1435347E-06 6 0.7172956E-08 7 0.2343230E-08 8 0.3949754E-09 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.5738564E+00 1 0.2957666E-01 2 0.1309075E-01 3 0.9697697E-03 4 0.2034553E-04 5 0.1855952E-05 6 0.2760437E-07 7 0.1867852E-08 8 0.4047728E-09 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.1074503E-13 1 0.1067547E-01 2 0.1228976E-02 3 0.6312095E-04 4 0.2029648E-04 5 0.1435333E-06 6 0.7172964E-08 7 0.2343255E-08 8 0.3949691E-09 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.5334285E-10 1 0.5518728E-01 2 0.1235529E-02 3 0.6813601E-03 4 0.1694349E-04 5 0.5055459E-06 6 0.3681629E-07 7 0.9344848E-08 8 0.7287995E-09 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.2270265E-05 1 0.2754999E-02 2 0.7979303E-02 3 0.4311852E-04 4 0.3879157E-04 5 0.7964027E-06 6 0.2074694E-07 7 0.4135151E-08 8 0.5005480E-08 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.5160618E-11 1 0.2132892E-03 2 0.2173679E-02 3 0.8008753E-03 4 0.1236649E-04 5 0.8763753E-06 6 0.5717929E-07 7 0.1312844E-08 8 0.3625210E-09 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.2461354E-12 1 0.6448930E-06 2 0.3038963E-03 3 0.4109796E-03 4 0.6062892E-04 5 0.1777755E-05 6 0.2034586E-07 7 0.7463706E-08 8 0.9346058E-09 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.2654543E-06 1 0.8543448E-06 2 0.8233185E-05 3 0.5690521E-04 4 0.2350601E-04 5 0.1659356E-05 6 0.3741243E-07 7 0.5774630E-08 8 0.4191965E-09 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1915208E-13 1 0.8015475E-07 2 0.3311610E-06 3 0.4216622E-05 4 0.3432626E-05 5 0.4392733E-06 6 0.1613081E-07 7 0.6151999E-08 8 0.4992766E-08 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.1059582E-12 1 0.8842012E-07 2 0.5729068E-07 3 0.2398868E-06 4 0.2154944E-06 5 0.4417968E-07 6 0.1638205E-08 7 0.1502780E-08 8 0.7382511E-09 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.4351429E-17 1 0.6738956E-10 2 0.8665015E-10 3 0.4480054E-10 4 0.2148090E-09 5 0.9733378E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.1095164E-09 1 0.7554262E-09 2 0.5636599E-09 3 0.2306785E-09 4 0.4869588E-09 5 0.5965545E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.2170739E-15 1 0.1758055E-08 2 0.3829989E-09 3 0.4960920E-09 4 0.4600459E-09 5 0.9951171E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.1304069E-15 1 0.2159572E-08 2 0.6962091E-08 3 0.3346877E-08 4 0.3512864E-09 5 0.1429290E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.4261344E-07 1 0.2722949E-07 2 0.2224181E-07 3 0.5467303E-08 4 0.8627226E-09 5 0.7507923E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.7431622E-15 1 0.3441508E-07 2 0.2673938E-07 3 0.1620943E-07 4 0.2754084E-08 5 0.5764407E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.7205015E-14 1 0.8594090E-06 2 0.2293311E-06 3 0.2781236E-07 4 0.3636222E-08 5 0.2733359E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.3027744E-07 1 0.1505049E-05 2 0.2995643E-05 3 0.1916638E-06 4 0.2904197E-07 5 0.1066135E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.3467603E-13 1 0.5293369E-05 2 0.2573850E-05 3 0.1238776E-06 4 0.1034447E-07 5 0.6828159E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.4834243E-15 1 0.1725323E-03 2 0.1191485E-04 3 0.7031950E-07 4 0.3485832E-07 5 0.1491559E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.1156811E-02 1 0.8185249E-03 2 0.2128586E-04 3 0.2768845E-06 4 0.3013912E-07 5 0.6510009E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.9974779E-16 1 0.1725323E-03 2 0.1191486E-04 3 0.7031841E-07 4 0.3485839E-07 5 0.1491561E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.3712170E-13 1 0.5293373E-05 2 0.2573848E-05 3 0.1238775E-06 4 0.1034446E-07 5 0.6828185E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.3028687E-07 1 0.1505044E-05 2 0.2995646E-05 3 0.1916638E-06 4 0.2904191E-07 5 0.1066131E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.2378045E-14 1 0.8594116E-06 2 0.2293321E-06 3 0.2781243E-07 4 0.3636239E-08 5 0.2733346E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.1143256E-14 1 0.3441531E-07 2 0.2674095E-07 3 0.1620949E-07 4 0.2754067E-08 5 0.5764448E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.4261357E-07 1 0.2722955E-07 2 0.2224193E-07 3 0.5467416E-08 4 0.8627273E-09 5 0.7507892E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.1666869E-15 1 0.2159588E-08 2 0.6962214E-08 3 0.3346876E-08 4 0.3512892E-09 5 0.1429311E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.1447328E-15 1 0.1758070E-08 2 0.3830108E-09 3 0.4960797E-09 4 0.4600454E-09 5 0.9951124E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.1095841E-09 1 0.7555781E-09 2 0.5636135E-09 3 0.2306797E-09 4 0.4869581E-09 5 0.5965526E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.1440750E-16 1 0.6741139E-10 2 0.8664968E-10 3 0.4479989E-10 4 0.2148121E-09 5 0.9733314E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.1233392E-04 1 0.4139761E-04 2 0.2451883E-03 3 0.7099964E-05 4 0.6153017E-06 5 0.7458908E-06 6 0.2002675E-06 7 0.2136892E-08 8 0.3885941E-10 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.2399667E-12 1 0.6064511E-06 2 0.6528480E-04 3 0.1421171E-04 4 0.2022665E-05 5 0.7184409E-06 6 0.2010543E-07 7 0.8353776E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.3021305E-13 1 0.4704591E-03 2 0.5046460E-03 3 0.1171851E-03 4 0.1349636E-04 5 0.4981723E-06 6 0.6642147E-08 7 0.8017029E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.2430409E-03 1 0.2399843E-03 2 0.6145616E-03 3 0.2581680E-04 4 0.9164311E-06 5 0.1160948E-05 6 0.7715533E-07 7 0.1901050E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.1301578E-13 1 0.4704591E-03 2 0.5046459E-03 3 0.1171851E-03 4 0.1349636E-04 5 0.4981709E-06 6 0.6642143E-08 7 0.8016973E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.2994283E-12 1 0.6064410E-06 2 0.6528479E-04 3 0.1421166E-04 4 0.2022686E-05 5 0.7184519E-06 6 0.2010573E-07 7 0.8353737E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.1294215E-12 1 0.3406878E-05 2 0.1522170E-03 3 0.2035566E-03 4 0.2831627E-04 5 0.3975661E-06 6 0.9472337E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.3248656E-07 1 0.4374839E-04 2 0.3285995E-03 3 0.1615448E-03 4 0.9979870E-05 5 0.6431916E-07 6 0.2246686E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.5511359E-12 1 0.4537340E-03 2 0.4438916E-03 3 0.1335068E-04 4 0.1830966E-06 5 0.2146033E-07 6 0.2241911E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.1636369E-13 1 0.5422726E-03 2 0.6241974E-04 3 0.9843395E-04 4 0.3401332E-05 5 0.2932725E-07 6 0.1377419E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.8098871E-03 1 0.7321074E-04 2 0.1808780E-03 3 0.1869362E-04 4 0.1549600E-05 5 0.7477422E-07 6 0.1459084E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.1602176E-14 1 0.5422726E-03 2 0.6241976E-04 3 0.9843397E-04 4 0.3401330E-05 5 0.2932728E-07 6 0.1377430E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.4574483E-12 1 0.4537339E-03 2 0.4438916E-03 3 0.1335070E-04 4 0.1830954E-06 5 0.2146077E-07 6 0.2241901E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.3245520E-07 1 0.4374840E-04 2 0.3285996E-03 3 0.1615448E-03 4 0.9979873E-05 5 0.6431898E-07 6 0.2246688E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.1343644E-12 1 0.3406834E-05 2 0.1522171E-03 3 0.2035566E-03 4 0.2831624E-04 5 0.3975658E-06 6 0.9472314E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.5505230E-10 1 0.3946220E-09 2 0.3661182E-08 3 0.3030564E-08 4 0.2035681E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.8701477E-16 1 0.6523578E-09 2 0.6081897E-08 3 0.2383491E-08 4 0.1901559E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.4143920E-15 1 0.1709661E-08 2 0.2806584E-07 3 0.1770677E-07 4 0.1287363E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.2469639E-09 1 0.1101682E-06 2 0.5165465E-06 3 0.9446911E-07 4 0.7545114E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.2872450E-14 1 0.2400519E-05 2 0.2696248E-05 3 0.1419521E-06 4 0.2741410E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.2474969E-15 1 0.4627380E-05 2 0.3832564E-06 3 0.5093858E-07 4 0.4245126E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.6269839E-04 1 0.2847550E-04 2 0.3398776E-06 3 0.2311627E-06 4 0.3268058E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.1606113E-15 1 0.4627381E-05 2 0.3832574E-06 3 0.5093843E-07 4 0.4245117E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.1195714E-14 1 0.2400521E-05 2 0.2696247E-05 3 0.1419521E-06 4 0.2741400E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.2475958E-09 1 0.1101689E-06 2 0.5165467E-06 3 0.9446908E-07 4 0.7545106E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.8301747E-15 1 0.1709848E-08 2 0.2806598E-07 3 0.1770665E-07 4 0.1287358E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.6494172E-16 1 0.6523003E-09 2 0.6081844E-08 3 0.2383517E-08 4 0.1901568E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.5505213E-10 1 0.3946397E-09 2 0.3661120E-08 3 0.3030549E-08 4 0.2035685E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 1.0000580 average vibrational energy (ev) = 0.005150 average rotational energy (ev) = 0.438864 average diffraction energy (ev) = 0.008117 the reaction probability = -0.5804850D-04 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.38986810D+01 trans energy = 0.49285714D+00 trans energy in z = 0.49285714D+00 total momentum = 0.11536724D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9852506E+00 0.1420463E-01 0.4277313E+00 1 0.1878066E-01 0.2838746E-01 0.1286862E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.5205575E-02 0 31 2 -2 0.3861113E-03 0 37 2 -1 0.4109673E-02 0 44 2 0 0.1710433E-01 0 50 2 1 0.4109673E-02 0 56 2 2 0.3861113E-03 0 21 4 -4 0.1783903E-03 0 26 4 -3 0.9062602E-03 0 32 4 -2 0.5191462E-02 0 38 4 -1 0.8075772E-02 0 45 4 0 0.2700158E-01 0 51 4 1 0.8075772E-02 0 57 4 2 0.5191462E-02 0 62 4 3 0.9062600E-03 0 67 4 4 0.1783901E-03 0 13 6 -6 0.4453073E-03 0 17 6 -5 0.1983054E-02 0 22 6 -4 0.5118627E-02 0 27 6 -3 0.1227840E-01 0 33 6 -2 0.1953350E-01 0 39 6 -1 0.9329404E-02 0 46 6 0 0.7432734E-01 0 52 6 1 0.9329402E-02 0 58 6 2 0.1953350E-01 0 63 6 3 0.1227840E-01 0 68 6 4 0.5118627E-02 0 72 6 5 0.1983054E-02 0 76 6 6 0.4453073E-03 0 7 8 -8 0.1468521E-04 0 10 8 -7 0.1097538E-03 0 14 8 -6 0.6060236E-03 0 18 8 -5 0.2985854E-02 0 23 8 -4 0.8133532E-02 0 28 8 -3 0.2061824E-01 0 34 8 -2 0.7338060E-01 0 40 8 -1 0.1506341E-01 0 47 8 0 0.4763043E+00 0 53 8 1 0.1506341E-01 0 59 8 2 0.7338060E-01 0 64 8 3 0.2061823E-01 0 69 8 4 0.8133532E-02 0 73 8 5 0.2985853E-02 0 77 8 6 0.6060235E-03 0 80 8 7 0.1097538E-03 0 83 8 8 0.1468515E-04 0 3 10 -10 0.2027070E-08 0 5 10 -9 0.1881625E-07 0 8 10 -8 0.3318393E-07 0 11 10 -7 0.9275441E-07 0 15 10 -6 0.2633169E-06 0 19 10 -5 0.4810341E-06 0 24 10 -4 0.3155615E-05 0 29 10 -3 0.3951222E-04 0 35 10 -2 0.3959128E-04 0 41 10 -1 0.7808802E-03 0 48 10 0 0.6683328E-02 0 54 10 1 0.7808802E-03 0 60 10 2 0.3959130E-04 0 65 10 3 0.3951227E-04 0 70 10 4 0.3155608E-05 0 74 10 5 0.4810492E-06 0 78 10 6 0.2633167E-06 0 81 10 7 0.9275198E-07 0 84 10 8 0.3318145E-07 0 86 10 9 0.1881453E-07 0 88 10 10 0.2027753E-08 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.6286886E-03 1 31 2 -2 0.1393205E-03 1 37 2 -1 0.7037946E-03 1 44 2 0 0.1211521E-02 1 50 2 1 0.7037946E-03 1 56 2 2 0.1393204E-03 1 21 4 -4 0.1576517E-02 1 26 4 -3 0.1219375E-02 1 32 4 -2 0.2112214E-02 1 38 4 -1 0.1470011E-02 1 45 4 0 0.1751861E-02 1 51 4 1 0.1470011E-02 1 57 4 2 0.2112214E-02 1 62 4 3 0.1219375E-02 1 67 4 4 0.1576517E-02 1 13 6 -6 0.1159161E-06 1 17 6 -5 0.8532953E-07 1 22 6 -4 0.3710201E-05 1 27 6 -3 0.2062870E-04 1 33 6 -2 0.8769143E-04 1 39 6 -1 0.5236883E-04 1 46 6 0 0.4169165E-03 1 52 6 1 0.5236885E-04 1 58 6 2 0.8769145E-04 1 63 6 3 0.2062871E-04 1 68 6 4 0.3710205E-05 1 72 6 5 0.8532542E-07 1 76 6 6 0.1159116E-06 1 7 8 -8 0.9653252E-12 1 10 8 -7 0.1943202E-11 1 14 8 -6 0.6041292E-10 1 18 8 -5 0.8628819E-12 1 23 8 -4 0.3957217E-11 1 28 8 -3 0.8519810E-10 1 34 8 -2 0.1201001E-10 1 40 8 -1 0.5598924E-11 1 47 8 0 0.5416184E-08 1 53 8 1 0.5598903E-11 1 59 8 2 0.1201016E-10 1 64 8 3 0.8519625E-10 1 69 8 4 0.3957299E-11 1 73 8 5 0.8628854E-12 1 77 8 6 0.6041316E-10 1 80 8 7 0.1943186E-11 1 83 8 8 0.9653168E-12 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.8917100E-03 1 0.6440158E-03 2 0.1349252E-02 3 0.1619777E-02 4 0.6490157E-03 5 0.4753508E-04 6 0.2121047E-05 7 0.1151333E-05 8 0.7590307E-06 9 0.2378290E-06 v, j, mj = 0 2 -2 0 0.1419564E-11 1 0.7680936E-04 2 0.2708631E-03 3 0.1344665E-04 4 0.1378488E-04 5 0.5769624E-05 6 0.1960928E-05 7 0.2056915E-05 8 0.1240380E-05 9 0.1794235E-06 v, j, mj = 0 2 -1 0 0.1118329E-12 1 0.2569479E-02 2 0.5589459E-03 3 0.5492190E-03 4 0.3919536E-03 5 0.3516275E-04 6 0.3651248E-05 7 0.9890228E-06 8 0.2519765E-06 9 0.1983267E-07 v, j, mj = 0 2 0 0 0.2200115E-02 1 0.8959221E-03 2 0.5578810E-02 3 0.6387405E-02 4 0.1900296E-02 5 0.1366993E-03 6 0.4094983E-05 7 0.3985095E-06 8 0.4799474E-06 9 0.1106803E-06 v, j, mj = 0 2 1 0 0.1283626E-12 1 0.2569479E-02 2 0.5589461E-03 3 0.5492189E-03 4 0.3919537E-03 5 0.3516271E-04 6 0.3651233E-05 7 0.9890229E-06 8 0.2519826E-06 9 0.1983265E-07 v, j, mj = 0 2 2 0 0.1279497E-11 1 0.7680933E-04 2 0.2708631E-03 3 0.1344672E-04 4 0.1378486E-04 5 0.5769597E-05 6 0.1960951E-05 7 0.2056921E-05 8 0.1240387E-05 9 0.1794240E-06 v, j, mj = 0 4 -4 0 0.9672494E-11 1 0.2340255E-05 2 0.1043926E-03 3 0.4803575E-04 4 0.1040848E-04 5 0.7035806E-05 6 0.3714648E-05 7 0.1983986E-05 8 0.4593810E-06 9 0.1939504E-07 v, j, mj = 0 4 -3 0 0.5940844E-07 1 0.1041708E-03 2 0.6564077E-03 3 0.8461609E-04 4 0.4393160E-04 5 0.1301217E-04 6 0.3242595E-05 7 0.7213798E-06 8 0.9450791E-07 9 0.3912738E-08 v, j, mj = 0 4 -2 0 0.7274308E-11 1 0.1265259E-02 2 0.3729796E-02 3 0.8911423E-04 4 0.8359887E-04 5 0.1914632E-04 6 0.3360843E-05 7 0.1061484E-05 8 0.1174280E-06 9 0.8144872E-08 v, j, mj = 0 4 -1 0 0.1231008E-11 1 0.3966827E-02 2 0.1448811E-02 3 0.1707147E-02 4 0.8231164E-03 5 0.1272383E-03 6 0.2480725E-05 7 0.1128883E-06 8 0.3567321E-07 9 0.3350345E-08 v, j, mj = 0 4 0 0 0.1405724E-02 1 0.3508162E-02 2 0.1238467E-01 3 0.8279272E-02 4 0.1395310E-02 5 0.2579587E-04 6 0.2319533E-05 7 0.2538305E-06 8 0.7252782E-07 9 0.5612496E-08 v, j, mj = 0 4 1 0 0.1351482E-11 1 0.3966827E-02 2 0.1448811E-02 3 0.1707146E-02 4 0.8231165E-03 5 0.1272382E-03 6 0.2480745E-05 7 0.1128746E-06 8 0.3567458E-07 9 0.3350479E-08 v, j, mj = 0 4 2 0 0.7638927E-11 1 0.1265259E-02 2 0.3729796E-02 3 0.8911446E-04 4 0.8359881E-04 5 0.1914625E-04 6 0.3360797E-05 7 0.1061477E-05 8 0.1174273E-06 9 0.8144886E-08 v, j, mj = 0 4 3 0 0.5941925E-07 1 0.1041707E-03 2 0.6564076E-03 3 0.8461612E-04 4 0.4393163E-04 5 0.1301213E-04 6 0.3242582E-05 7 0.7213871E-06 8 0.9450843E-07 9 0.3912966E-08 v, j, mj = 0 4 4 0 0.9681369E-11 1 0.2340272E-05 2 0.1043925E-03 3 0.4803575E-04 4 0.1040848E-04 5 0.7035782E-05 6 0.3714620E-05 7 0.1983989E-05 8 0.4593848E-06 9 0.1939523E-07 v, j, mj = 0 6 -6 0 0.1581406E-05 1 0.1088027E-05 2 0.2885523E-04 3 0.3040471E-03 4 0.8343008E-04 5 0.1867697E-04 6 0.6773429E-05 7 0.8295446E-06 8 0.2501620E-07 9 0.4381020E-09 v, j, mj = 0 6 -5 0 0.6459477E-12 1 0.1331875E-04 2 0.5988151E-03 3 0.1281824E-02 4 0.7730213E-04 5 0.8776332E-05 6 0.2647852E-05 7 0.3583629E-06 8 0.1045810E-07 9 0.7912503E-09 v, j, mj = 0 6 -4 0 0.8496500E-11 1 0.4780323E-04 2 0.3221824E-02 3 0.1734388E-02 4 0.1038481E-03 5 0.8895052E-05 6 0.1749478E-05 7 0.1135326E-06 8 0.4734230E-08 9 0.8769432E-09 v, j, mj = 0 6 -3 0 0.1881135E-05 1 0.1467395E-02 2 0.7271953E-02 3 0.3310991E-02 4 0.2207344E-03 5 0.4211432E-05 6 0.1162148E-05 7 0.6305179E-07 8 0.5482909E-08 9 0.5789790E-09 v, j, mj = 0 6 -2 0 0.6328750E-10 1 0.6446185E-02 2 0.9845134E-02 3 0.2872915E-02 4 0.3416943E-03 5 0.2676432E-04 6 0.7509758E-06 7 0.5206305E-07 8 0.2625137E-08 9 0.1755056E-08 v, j, mj = 0 6 -1 0 0.9424233E-13 1 0.1735647E-02 2 0.1686513E-02 3 0.4136494E-02 4 0.1733883E-02 5 0.3673622E-04 6 0.1144231E-06 7 0.1169376E-07 8 0.3227778E-08 9 0.6891956E-09 v, j, mj = 0 6 0 0 0.4981328E-02 1 0.3544298E-01 2 0.2126336E-01 3 0.1092919E-01 4 0.1668858E-02 5 0.4092933E-04 6 0.6567563E-06 7 0.3630572E-07 8 0.4365216E-08 9 0.1874889E-08 v, j, mj = 0 6 1 0 0.5010631E-12 1 0.1735650E-02 2 0.1686511E-02 3 0.4136492E-02 4 0.1733882E-02 5 0.3673617E-04 6 0.1144314E-06 7 0.1169496E-07 8 0.3227694E-08 9 0.6892055E-09 v, j, mj = 0 6 2 0 0.7090316E-10 1 0.6446186E-02 2 0.9845133E-02 3 0.2872914E-02 4 0.3416937E-03 5 0.2676423E-04 6 0.7509823E-06 7 0.5206401E-07 8 0.2625427E-08 9 0.1755071E-08 v, j, mj = 0 6 3 0 0.1881405E-05 1 0.1467396E-02 2 0.7271953E-02 3 0.3310990E-02 4 0.2207345E-03 5 0.4211437E-05 6 0.1162163E-05 7 0.6305528E-07 8 0.5483148E-08 9 0.5789936E-09 v, j, mj = 0 6 4 0 0.7904001E-11 1 0.4780294E-04 2 0.3221825E-02 3 0.1734388E-02 4 0.1038481E-03 5 0.8895126E-05 6 0.1749470E-05 7 0.1135336E-06 8 0.4734415E-08 9 0.8769422E-09 v, j, mj = 0 6 5 0 0.7009434E-12 1 0.1331833E-04 2 0.5988152E-03 3 0.1281824E-02 4 0.7730216E-04 5 0.8776336E-05 6 0.2647843E-05 7 0.3583628E-06 8 0.1045808E-07 9 0.7912406E-09 v, j, mj = 0 6 6 0 0.1581407E-05 1 0.1088036E-05 2 0.2885511E-04 3 0.3040470E-03 4 0.8343029E-04 5 0.1867701E-04 6 0.6773425E-05 7 0.8295411E-06 8 0.2501622E-07 9 0.4380931E-09 v, j, mj = 0 8 -8 0 0.4195709E-13 1 0.4182752E-06 2 0.2555685E-06 3 0.3671661E-05 4 0.7748853E-05 5 0.2458126E-05 6 0.1276166E-06 7 0.3431379E-08 8 0.1677034E-08 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.2214872E-12 1 0.5096732E-07 2 0.2395088E-05 3 0.4852777E-04 4 0.4967179E-04 5 0.8700821E-05 6 0.3954166E-06 7 0.7973144E-08 8 0.3966669E-08 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.1576640E-05 1 0.2823340E-05 2 0.6389031E-04 3 0.3959071E-03 4 0.1299635E-03 5 0.1158462E-04 6 0.2558729E-06 7 0.2072706E-07 8 0.1448254E-08 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1140493E-11 1 0.8866977E-05 2 0.1364426E-02 3 0.1500045E-02 4 0.1074059E-03 5 0.4870778E-05 6 0.2178805E-06 7 0.1948020E-07 8 0.1286544E-08 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.3177613E-10 1 0.5515768E-03 2 0.6333876E-02 3 0.1212383E-02 4 0.2965076E-04 5 0.5944999E-05 6 0.9650314E-07 7 0.2886670E-08 8 0.1309655E-08 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.5175369E-05 1 0.5844085E-02 2 0.1339536E-01 3 0.1285224E-02 4 0.8748943E-04 5 0.7948334E-06 6 0.1057865E-06 7 0.2410961E-08 8 0.2895140E-08 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1930880E-09 1 0.6754794E-01 2 0.5138707E-02 3 0.6467770E-03 4 0.4512434E-04 5 0.1988371E-05 6 0.4735907E-07 7 0.1132589E-07 8 0.1937406E-08 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.2588033E-12 1 0.9851747E-02 2 0.4607733E-02 3 0.5558732E-03 4 0.4715631E-04 5 0.8863811E-06 6 0.7643934E-08 7 0.2600890E-08 8 0.5962330E-09 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.3449745E+00 1 0.1221862E+00 2 0.8168964E-02 3 0.8397606E-03 4 0.1340131E-03 5 0.9462646E-06 6 0.3093957E-07 7 0.6113198E-08 8 0.7547058E-09 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.7317165E-15 1 0.9851743E-02 2 0.4607736E-02 3 0.5558728E-03 4 0.4715638E-04 5 0.8863793E-06 6 0.7643218E-08 7 0.2600975E-08 8 0.5962437E-09 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.2070803E-09 1 0.6754794E-01 2 0.5138706E-02 3 0.6467771E-03 4 0.4512442E-04 5 0.1988377E-05 6 0.4735983E-07 7 0.1132585E-07 8 0.1937424E-08 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.5173246E-05 1 0.5844083E-02 2 0.1339536E-01 3 0.1285225E-02 4 0.8748942E-04 5 0.7948663E-06 6 0.1057834E-06 7 0.2411005E-08 8 0.2895124E-08 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.2828797E-10 1 0.5515768E-03 2 0.6333876E-02 3 0.1212383E-02 4 0.2965099E-04 5 0.5945014E-05 6 0.9650426E-07 7 0.2886672E-08 8 0.1309648E-08 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1549541E-11 1 0.8866110E-05 2 0.1364427E-02 3 0.1500045E-02 4 0.1074061E-03 5 0.4870785E-05 6 0.2178804E-06 7 0.1948016E-07 8 0.1286535E-08 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1576639E-05 1 0.2823358E-05 2 0.6389007E-04 3 0.3959072E-03 4 0.1299636E-03 5 0.1158462E-04 6 0.2558719E-06 7 0.2072708E-07 8 0.1448251E-08 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.2796161E-12 1 0.5094707E-07 2 0.2395047E-05 3 0.4852782E-04 4 0.4967178E-04 5 0.8700821E-05 6 0.3954162E-06 7 0.7973160E-08 8 0.3966667E-08 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.6552980E-13 1 0.4182733E-06 2 0.2555560E-06 3 0.3671637E-05 4 0.7748845E-05 5 0.2458118E-05 6 0.1276156E-06 7 0.3431383E-08 8 0.1677032E-08 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.6285929E-15 1 0.6804352E-10 2 0.4904216E-09 3 0.4725615E-09 4 0.6325346E-09 5 0.2780713E-09 6 0.8543643E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.4296634E-09 1 0.5185278E-08 2 0.7650912E-08 3 0.2385259E-08 4 0.2813115E-08 5 0.2425754E-09 6 0.1094495E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.7346435E-14 1 0.1386466E-07 2 0.1040023E-07 3 0.7763702E-08 4 0.5820756E-09 5 0.4677145E-09 6 0.1055432E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.1536987E-14 1 0.5204984E-07 2 0.2911290E-07 3 0.9566775E-08 4 0.1203847E-08 5 0.6902229E-09 6 0.1308241E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.1970429E-06 1 0.2547227E-07 2 0.1258779E-07 3 0.2137221E-07 4 0.5071602E-08 5 0.1504895E-08 6 0.2652420E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.9987513E-14 1 0.5781110E-07 2 0.2537548E-06 3 0.1567940E-06 4 0.8973805E-08 5 0.3039830E-08 6 0.6605578E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.7653768E-13 1 0.1173265E-05 2 0.1393417E-05 3 0.5685313E-06 4 0.1736984E-07 5 0.2758571E-08 6 0.2735850E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.6546372E-07 1 0.1228928E-04 2 0.2622642E-04 3 0.8901046E-06 4 0.2570422E-07 5 0.1140219E-07 6 0.3840900E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.3473050E-12 1 0.3014658E-04 2 0.8762976E-05 3 0.6508129E-06 4 0.2517857E-07 5 0.4613164E-08 6 0.1121472E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.6426023E-14 1 0.7651191E-03 2 0.1439157E-04 3 0.1286294E-05 4 0.3627806E-07 5 0.4592623E-07 6 0.1055408E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.4248311E-02 1 0.2385278E-02 2 0.4839955E-04 3 0.1228700E-05 4 0.8769603E-07 5 0.2085738E-07 6 0.2111014E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.2064310E-15 1 0.7651191E-03 2 0.1439159E-04 3 0.1286294E-05 4 0.3627769E-07 5 0.4592635E-07 6 0.1055379E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.3668165E-12 1 0.3014660E-04 2 0.8762976E-05 3 0.6508114E-06 4 0.2517859E-07 5 0.4613199E-08 6 0.1121486E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.6550749E-07 1 0.1228927E-04 2 0.2622644E-04 3 0.8901048E-06 4 0.2570434E-07 5 0.1140218E-07 6 0.3840909E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.3927403E-13 1 0.1173254E-05 2 0.1393418E-05 3 0.5685342E-06 4 0.1737000E-07 5 0.2758568E-08 6 0.2735811E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.1568599E-13 1 0.5781374E-07 2 0.2537660E-06 3 0.1567950E-06 4 0.8973955E-08 5 0.3039832E-08 6 0.6605729E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.1970430E-06 1 0.2547329E-07 2 0.1258639E-07 3 0.2137215E-07 4 0.5071705E-08 5 0.1504892E-08 6 0.2652458E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.1658511E-14 1 0.5204790E-07 2 0.2911210E-07 3 0.9567082E-08 4 0.1203847E-08 5 0.6902210E-09 6 0.1308248E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.5548526E-14 1 0.1386205E-07 2 0.1040023E-07 3 0.7763819E-08 4 0.5820815E-09 5 0.4677146E-09 6 0.1055443E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.4287221E-09 1 0.5185293E-08 2 0.7649803E-08 3 0.2385567E-08 4 0.2813117E-08 5 0.2425754E-09 6 0.1094502E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.1561251E-14 1 0.6796827E-10 2 0.4910980E-09 3 0.4726419E-09 4 0.6325376E-09 5 0.2780699E-09 6 0.8543608E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.1428324E-04 1 0.9357019E-04 2 0.4902715E-03 3 0.2631345E-04 4 0.2824565E-05 5 0.8387982E-06 6 0.5697428E-06 7 0.1620603E-07 8 0.9923018E-09 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.3631250E-11 1 0.5924049E-04 2 0.2442263E-04 3 0.2621379E-04 4 0.1303097E-04 5 0.1527268E-04 6 0.1128145E-05 7 0.1152793E-07 8 0.2976498E-09 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.6086858E-12 1 0.1907911E-03 2 0.4160022E-03 3 0.7955316E-04 4 0.1627234E-04 5 0.1140042E-05 6 0.3388499E-07 7 0.1607894E-08 8 0.2662706E-09 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.9231564E-04 1 0.1326600E-03 2 0.8814904E-03 3 0.9250242E-04 4 0.1057466E-04 5 0.1582438E-05 6 0.3844703E-06 7 0.7854350E-08 8 0.2784608E-08 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.5597767E-12 1 0.1907910E-03 2 0.4160023E-03 3 0.7955311E-04 4 0.1627236E-04 5 0.1140037E-05 6 0.3388505E-07 7 0.1607873E-08 8 0.2662678E-09 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.4143922E-11 1 0.5924043E-04 2 0.2442265E-04 3 0.2621376E-04 4 0.1303093E-04 5 0.1527264E-04 6 0.1128140E-05 7 0.1152787E-07 8 0.2976517E-09 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.1875489E-11 1 0.2371242E-04 2 0.6024664E-03 3 0.6854715E-03 4 0.2508431E-03 5 0.1394740E-04 6 0.7580860E-07 7 0.4357125E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.1268180E-06 1 0.1848817E-03 2 0.8991433E-03 3 0.1339392E-03 4 0.1006966E-05 5 0.2739106E-06 6 0.2667953E-08 7 0.7969925E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.4199966E-11 1 0.1148139E-02 2 0.9398818E-03 3 0.1919666E-04 4 0.4522383E-05 5 0.4572343E-06 6 0.1582085E-07 7 0.8857048E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.5391485E-13 1 0.7912274E-03 2 0.4326941E-03 3 0.2444986E-03 4 0.1446461E-05 5 0.1387329E-06 6 0.4432160E-08 7 0.7479572E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.7780565E-03 1 0.1004833E-03 2 0.7001638E-03 3 0.1642785E-03 4 0.8604295E-05 5 0.2496158E-06 6 0.2374157E-07 7 0.1377428E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.7357656E-13 1 0.7912272E-03 2 0.4326943E-03 3 0.2444987E-03 4 0.1446460E-05 5 0.1387332E-06 6 0.4432213E-08 7 0.7479611E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.4228317E-11 1 0.1148139E-02 2 0.9398818E-03 3 0.1919671E-04 4 0.4522376E-05 5 0.4572343E-06 6 0.1582094E-07 7 0.8857086E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.1266344E-06 1 0.1848815E-03 2 0.8991434E-03 3 0.1339394E-03 4 0.1006990E-05 5 0.2739091E-06 6 0.2667842E-08 7 0.7969906E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.1813189E-11 1 0.2371220E-04 2 0.6024669E-03 3 0.6854712E-03 4 0.2508428E-03 5 0.1394737E-04 6 0.7580845E-07 7 0.4357137E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.1357501E-07 1 0.2288331E-08 2 0.6527485E-07 3 0.2611945E-07 4 0.4492360E-08 5 0.4166053E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.1371232E-13 1 0.4513807E-07 2 0.2333060E-07 3 0.1092031E-07 4 0.3593481E-08 5 0.2347052E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.1693573E-13 1 0.2942949E-07 2 0.2381760E-05 3 0.1200644E-05 4 0.9513463E-07 5 0.3233107E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.1828944E-08 1 0.3466122E-05 2 0.1486304E-04 3 0.2272116E-05 4 0.2452931E-07 5 0.1071095E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.9514456E-13 1 0.4511274E-04 2 0.4138103E-04 3 0.1129291E-05 4 0.4902636E-07 5 0.1934944E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.2280479E-14 1 0.4822579E-04 2 0.1123848E-05 3 0.2932426E-05 4 0.8515620E-07 5 0.1615253E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.3220330E-03 1 0.8811165E-04 2 0.5835823E-05 3 0.8079724E-06 4 0.1233317E-06 5 0.4663110E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.1985767E-14 1 0.4822580E-04 2 0.1123854E-05 3 0.2932424E-05 4 0.8515613E-07 5 0.1615250E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.6784444E-13 1 0.4511275E-04 2 0.4138103E-04 3 0.1129292E-05 4 0.4902638E-07 5 0.1934944E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.1826201E-08 1 0.3466127E-05 2 0.1486304E-04 3 0.2272117E-05 4 0.2452936E-07 5 0.1071087E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.1621708E-13 1 0.2943496E-07 2 0.2381760E-05 3 0.1200643E-05 4 0.9513446E-07 5 0.3233100E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.1679283E-13 1 0.4513602E-07 2 0.2332857E-07 3 0.1092026E-07 4 0.3593499E-08 5 0.2347048E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.1357511E-07 1 0.2288360E-08 2 0.6527106E-07 3 0.2611867E-07 4 0.4492371E-08 5 0.4166054E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -8 0 0.4056360E-16 1 0.9652846E-12 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -7 0 0.5821781E-18 1 0.1943202E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -6 0 0.5876220E-10 1 0.1650719E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -5 0 0.2072722E-17 1 0.8628798E-12 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -4 0 0.3300798E-17 1 0.3957214E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -3 0 0.7252409E-10 1 0.1267401E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -2 0 0.3468328E-18 1 0.1201001E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -1 0 0.6461033E-18 1 0.5598923E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 0 0 0.5194770E-08 1 0.2214143E-09 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 1 0 0.4384447E-18 1 0.5598902E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 2 0 0.2527045E-18 1 0.1201016E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 3 0 0.7252249E-10 1 0.1267375E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 4 0 0.3063752E-17 1 0.3957296E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 5 0 0.1899341E-17 1 0.8628835E-12 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 6 0 0.5876235E-10 1 0.1650809E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 7 0 0.5632661E-18 1 0.1943186E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 8 0 0.4213159E-16 1 0.9652747E-12 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 1.0040313 average vibrational energy (ev) = 0.009529 average rotational energy (ev) = 0.422138 average diffraction energy (ev) = 0.014470 the reaction probability = -0.4031294D-02 etrans(icomin)= 0.151114 etrans(icomax)= 0.548327 etrans= 0.550000 CPU TIMES Total computation 188981.5384 (a) ... Propagating the wavefunction 185291.0090 (b) Setup time 3246.9131 Saving the wave function for rerun 119.1798 Calculating averages 8.3908 Calculating and saving BK-coeffs 41.3012 Asymptotic analysis 9.3752 Saving the flux coefficients 0.0000 Flux analysis 0.0000 ----------------------------------------------------- Sum 188716.1691 (a) ... FFTs along X and Y 8280.0535 Kinetic energy operation along Z 48274.7544 Kinetic energy operation along r 37688.8836 Potential energy multiplication 21174.3743 Legengre transforms 57217.4735 Shifting the wavefunction 4355.0514 Kinetic energy multiplications (xy) 880.3179 Absorbing the wavefunction 993.6031 Projection formalism 20.2034 Operations on specular grid 0.1784 ----------------------------------------------------- Sum 178884.8934 (b) ... Potential initialisation time 0.0000 Potential setup time 3166.9049 FFTs along X 4385.9047 FFTs along Y 3894.1487 Time spent on FGH for asympwf 0.6129 Ending date and time: Tue Aug 13 01:56:12 CEST 2019