Starting date and time: Tue Aug 13 11:46:43 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 20190813 at 114643.500 *** * 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: v0j8mj6-0.15eV-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: 6 * 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: 6 * 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 = 6 ... *** 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 = 0.29087067E-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 = 91 iz = 92 iz = 93 iz = 94 iz = 95 iz = 96 iz = 97 iz = 98 iz = 99 iz = 100 iz = 101 iz = 102 iz = 103 iz = 104 iz = 105 iz = 106 iz = 107 iz = 108 iz = 109 iz = 110 iz = 111 iz = 112 iz = 113 iz = 114 iz = 115 iz = 116 iz = 117 iz = 118 iz = 119 iz = 120 iz = 121 iz = 122 iz = 123 iz = 124 iz = 125 iz = 126 iz = 127 iz = 128 iz = 129 iz = 130 iz = 131 iz = 132 iz = 133 iz = 134 iz = 135 iz = 136 iz = 137 iz = 138 iz = 139 iz = 140 iz = 141 iz = 142 iz = 145 iz = 149 iz = 153 iz = 146 iz = 157 iz = 150 iz = 161 iz = 154 iz = 144 iz = 143 iz = 158 iz = 148 iz = 162 iz = 152 iz = 156 iz = 160 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 = 0.25999126E+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 = 367 ******************************************************************************** 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 = 20597 ******************************************************************************** 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 13.99129288 1.53575904 0.23771132E-01 0.14000000E+04 0.99999977 13.86493455 1.53575533 0.16830009E-01 0.14500000E+04 0.99999976 13.73855600 1.53575547 0.11939073E-01 0.15000000E+04 0.99999975 13.61215542 1.53576524 0.84968641E-02 0.15500000E+04 0.99999975 13.48573071 1.53577659 0.60728911E-02 0.16000000E+04 0.99999974 13.35927948 1.53577895 0.43625372E-02 0.16500000E+04 0.99999973 13.23279898 1.53578247 0.31518931E-02 0.17000000E+04 0.99999972 13.10628609 1.53579004 0.22914455E-02 0.17500000E+04 0.99999971 12.97973729 1.53579745 0.16769331E-02 0.18000000E+04 0.99999970 12.85314867 1.53581031 0.12356814E-02 0.18500000E+04 0.99999970 12.72651594 1.53583367 0.91698059E-03 0.19000000E+04 0.99999969 12.59983447 1.53586289 0.68536713E-03 0.19500000E+04 0.99999968 12.47309932 1.53588593 0.51596036E-03 0.20000000E+04 0.99999967 12.34630531 1.53590729 0.39123502E-03 0.20500000E+04 0.99999966 12.21944702 1.53593643 0.29879173E-03 0.21000000E+04 0.99999965 12.09251887 1.53596627 0.22981307E-03 0.21500000E+04 0.99999965 11.96551516 1.53600066 0.17799621E-03 0.22000000E+04 0.99999964 11.83843007 1.53604422 0.13881063E-03 0.22500000E+04 0.99999963 11.71125768 1.53609473 0.10898072E-03 0.23000000E+04 0.99999962 11.58399202 1.53614008 0.86124896E-04 0.23500000E+04 0.99999961 11.45662704 1.53617968 0.68500151E-04 0.24000000E+04 0.99999961 11.32915664 1.53622547 0.54823657E-04 0.24500000E+04 0.99999960 11.20157465 1.53627416 0.44145428E-04 0.25000000E+04 0.99999959 11.07387489 1.53632309 0.35757763E-04 0.25500000E+04 0.99999958 10.94605115 1.53638055 0.29130361E-04 0.26000000E+04 0.99999957 10.81809723 1.53644351 0.23863568E-04 0.26500000E+04 0.99999956 10.69000702 1.53650349 0.19654244E-04 0.27000000E+04 0.99999956 10.56177449 1.53655502 0.16272076E-04 0.27500000E+04 0.99999955 10.43339386 1.53660976 0.13539913E-04 0.28000000E+04 0.99999954 10.30485962 1.53667092 0.11321480E-04 0.28500000E+04 0.99999953 10.17616671 1.53673102 0.95112074E-05 0.29000000E+04 0.99999952 10.04731065 1.53679793 0.80268802E-05 0.29500000E+04 0.99999952 9.91828773 1.53687230 0.68039204E-05 0.30000000E+04 0.99999951 9.78909521 1.53694560 0.57921493E-05 0.30500000E+04 0.99999950 9.65973156 1.53701218 0.49512914E-05 0.31000000E+04 0.99999949 9.53019672 1.53708038 0.42495142E-05 0.31500000E+04 0.99999948 9.40049244 1.53715931 0.36613978E-05 0.32000000E+04 0.99999947 9.27062258 1.53724277 0.31665668E-05 0.32500000E+04 0.99999947 9.14059349 1.53733334 0.27486215E-05 0.33000000E+04 0.99999946 9.01041439 1.53743912 0.23942895E-05 0.33500000E+04 0.99999945 8.88009783 1.53755202 0.20927669E-05 0.34000000E+04 0.99999944 8.74966012 1.53766892 0.18352258E-05 0.34500000E+04 0.99999943 8.61912177 1.53779616 0.16144510E-05 0.35000000E+04 0.99999942 8.48850801 1.53794920 0.14245508E-05 0.35500000E+04 0.99999942 8.35784927 1.53812810 0.12604640E-05 0.36000000E+04 0.99999941 8.22718166 1.53833404 0.11186755E-05 0.36500000E+04 0.99999940 8.09654743 1.53858100 0.99558891E-06 0.37000000E+04 0.99999939 7.96599548 1.53887067 0.88838991E-06 0.37500000E+04 0.99999938 7.83558178 1.53920206 0.79473087E-06 0.38000000E+04 0.99999937 7.70536976 1.53958803 0.71267240E-06 0.38500000E+04 0.99999935 7.57543072 1.54004857 0.64060936E-06 0.39000000E+04 0.99999933 7.44584410 1.54059844 0.57719158E-06 0.39500000E+04 0.99999930 7.31669774 1.54124186 0.52105902E-06 0.40000000E+04 0.99999925 7.18808806 1.54199812 0.47162930E-06 0.40500000E+04 0.99999916 7.06012014 1.54288316 0.42783058E-06 0.41000000E+04 0.99999901 6.93290775 1.54390043 0.38891351E-06 0.41500000E+04 0.99999877 6.80657321 1.54506648 0.35422361E-06 0.42000000E+04 0.99999837 6.68124727 1.54640430 0.32320365E-06 0.42500000E+04 0.99999773 6.55706877 1.54793321 0.29540667E-06 0.43000000E+04 0.99999673 6.43418423 1.54965885 0.27049142E-06 0.43500000E+04 0.99999518 6.31274736 1.55158923 0.24799147E-06 0.44000000E+04 0.99999286 6.19291844 1.55373658 0.22803522E-06 0.44500000E+04 0.99998943 6.07486362 1.55609650 0.21013686E-06 0.45000000E+04 0.99998450 5.95875411 1.55866413 0.19400461E-06 0.45500000E+04 0.99997751 5.84476526 1.56144455 0.17937917E-06 0.46000000E+04 0.99996782 5.73307557 1.56443533 0.16606172E-06 0.46500000E+04 0.99995461 5.62386557 1.56762313 0.15390950E-06 0.47000000E+04 0.99993692 5.51731665 1.57098562 0.14281148E-06 0.47500000E+04 0.99991362 5.41360991 1.57450470 0.13266900E-06 0.48000000E+04 0.99988345 5.31292493 1.57815014 0.12339444E-06 0.48500000E+04 0.99984496 5.21543867 1.58188057 0.11491727E-06 0.49000000E+04 0.99979662 5.12132439 1.58565996 0.10718040E-06 0.49500000E+04 0.99973676 5.03075060 1.58944964 0.10012652E-06 0.50000000E+04 0.99966368 4.94388016 1.59320024 0.93485763E-07 0.50500000E+04 0.99957566 4.86086936 1.59685663 0.87596221E-07 0.51000000E+04 0.99947103 4.78186714 1.60036673 0.82176347E-07 0.51500000E+04 0.99934823 4.70701436 1.60368301 0.77167433E-07 0.52000000E+04 0.99920588 4.63644317 1.60675581 0.72530147E-07 0.52500000E+04 0.99904284 4.57027632 1.60954811 0.68237383E-07 0.53000000E+04 0.99885828 4.50862654 1.61203695 0.64264836E-07 0.53500000E+04 0.99865171 4.45159589 1.61420179 0.60587069E-07 0.54000000E+04 0.99842306 4.39927516 1.61602205 0.57180613E-07 0.54500000E+04 0.99817266 4.35174341 1.61747726 0.54025284E-07 0.55000000E+04 0.99790131 4.30906781 1.61854746 0.51104603E-07 0.55500000E+04 0.99761022 4.27130363 1.61920808 0.48400835E-07 0.56000000E+04 0.99730103 4.23849460 1.61943627 0.45707225E-07 0.56500000E+04 0.99697577 4.21067315 1.61922263 0.43390337E-07 0.57000000E+04 0.99663677 4.18786068 1.61857093 0.41235594E-07 0.57500000E+04 0.99628670 4.17006757 1.61750075 0.39212208E-07 0.58000000E+04 0.99592840 4.15729290 1.61605270 0.37304208E-07 0.58500000E+04 0.99556491 4.14952386 1.61428590 0.35503994E-07 0.59000000E+04 0.99519936 4.14673512 1.61226701 0.33803593E-07 0.59500000E+04 0.99483496 4.14888843 1.61005527 0.32218080E-07 0.60000000E+04 0.99447491 4.15593258 1.60769594 0.30695063E-07 0.60500000E+04 0.99412237 4.16780409 1.60521361 0.29185223E-07 0.61000000E+04 0.99378042 4.18442856 1.60261199 0.27817374E-07 0.61500000E+04 0.99345196 4.20572255 1.59988552 0.26571538E-07 0.62000000E+04 0.99313968 4.23159562 1.59703431 0.25114710E-07 0.62500000E+04 0.99284596 4.26195216 1.59407607 0.24006391E-07 0.63000000E+04 0.99257277 4.29669256 1.59105207 0.23068119E-07 0.63500000E+04 0.99232163 4.33571364 1.58802631 0.21870919E-07 0.64000000E+04 0.99209352 4.37890835 1.58507475 0.20871097E-07 0.64500000E+04 0.99188890 4.42616524 1.58226365 0.20446199E-07 0.65000000E+04 0.99170766 4.47736806 1.57963031 0.19504999E-07 0.65500000E+04 0.99154918 4.53239608 1.57717251 0.18175172E-07 0.66000000E+04 0.99141237 4.59112524 1.57485048 0.18119966E-07 0.66500000E+04 0.99129576 4.65342991 1.57260471 0.18246096E-07 0.67000000E+04 0.99119758 4.71918488 1.57038499 0.16676499E-07 0.67500000E+04 0.99111586 4.78826668 1.56817879 0.15951378E-07 0.68000000E+04 0.99104854 4.86055411 1.56602145 0.17774409E-07 ==> ZAnalysis on specular channel fixed at Z = 0.16700000E+02 0.68500000E+04 0.99099354 4.93592766 1.56398196 0.18736487E-07 0.69000000E+04 0.99094891 5.01426846 1.56213011 0.16790411E-07 0.69500000E+04 0.99091280 5.09545721 1.56049875 0.17993321E-07 0.70000000E+04 0.99088363 5.17937372 1.55906200 0.23785026E-07 0.70500000E+04 0.99086000 5.26589739 1.55774384 0.26976317E-07 0.71000000E+04 0.99084080 5.35490823 1.55645489 0.26338668E-07 0.71500000E+04 0.99082509 5.44628802 1.55513796 0.30786934E-07 0.72000000E+04 0.99081214 5.53992112 1.55379642 0.42485787E-07 0.72500000E+04 0.99080137 5.63569459 1.55248938 0.51596209E-07 0.73000000E+04 0.99079230 5.73349764 1.55129453 0.54376057E-07 0.73500000E+04 0.99078450 5.83322103 1.55026054 0.60491707E-07 0.74000000E+04 0.99077762 5.93475659 1.54937828 0.74883741E-07 0.74500000E+04 0.99077131 6.03799730 1.54858758 0.87481670E-07 0.75000000E+04 0.99076524 6.14283789 1.54781452 0.89580208E-07 0.75500000E+04 0.99075906 6.24917560 1.54701519 0.86753186E-07 0.76000000E+04 0.99075241 6.35691082 1.54619914 0.86480416E-07 0.76500000E+04 0.99074486 6.46594733 1.54541829 0.85100272E-07 0.77000000E+04 0.99073596 6.57619209 1.54472933 0.76787914E-07 0.77500000E+04 0.99072512 6.68755474 1.54415546 0.65240316E-07 0.78000000E+04 0.99071169 6.79994716 1.54367269 0.57493614E-07 0.78500000E+04 0.99069485 6.91328310 1.54322783 0.57179472E-07 0.79000000E+04 0.99067362 7.02747809 1.54277408 0.76013271E-07 0.79500000E+04 0.99064687 7.14244963 1.54229925 0.14352412E-06 0.80000000E+04 0.99061322 7.25811724 1.54182861 0.29099148E-06 0.80500000E+04 0.99057108 7.37440254 1.54140191 0.53105863E-06 0.81000000E+04 0.99051864 7.49122912 1.54104290 0.87166297E-06 0.81500000E+04 0.99045382 7.60852238 1.54074290 0.13561842E-05 0.82000000E+04 0.99037430 7.72620924 1.54046918 0.20792138E-05 0.82500000E+04 0.99027749 7.84421814 1.54019026 0.31560327E-05 0.83000000E+04 0.99016057 7.96247907 1.53989859 0.46878549E-05 0.83500000E+04 0.99002049 8.08092379 1.53961377 0.67794873E-05 0.84000000E+04 0.98985394 8.19948608 1.53936502 0.96136488E-05 0.84500000E+04 0.98965743 8.31810185 1.53916698 0.13528392E-04 0.85000000E+04 0.98942720 8.43670919 1.53900774 0.19042646E-04 0.85500000E+04 0.98915928 8.55524819 1.53885753 0.26823279E-04 0.86000000E+04 0.98884946 8.67366071 1.53869112 0.37652799E-04 0.86500000E+04 0.98849327 8.79189014 1.53850647 0.52476797E-04 0.87000000E+04 0.98808593 8.90988118 1.53832516 0.72549491E-04 0.87500000E+04 0.98762238 9.02757977 1.53817442 0.99601273E-04 0.88000000E+04 0.98709720 9.14493287 1.53806489 0.13591859E-03 0.88500000E+04 0.98650462 9.26188840 1.53798165 0.18430649E-03 0.89000000E+04 0.98583848 9.37839503 1.53789526 0.24802825E-03 0.89500000E+04 0.98509222 9.49440203 1.53778428 0.33086601E-03 0.90000000E+04 0.98425890 9.60985916 1.53765214 0.43733900E-03 0.90500000E+04 0.98333120 9.72471674 1.53752509 0.57295146E-03 0.91000000E+04 0.98230143 9.83892582 1.53743221 0.74426129E-03 0.91500000E+04 0.98116163 9.95243854 1.53738256 0.95864917E-03 0.92000000E+04 0.97990354 10.06520846 1.53735717 0.12238751E-02 0.92500000E+04 0.97851878 10.17719099 1.53732224 0.15476530E-02 0.93000000E+04 0.97699886 10.28834387 1.53725369 0.19374133E-02 0.93500000E+04 0.97533528 10.39862753 1.53715485 0.24002066E-02 0.94000000E+04 0.97351972 10.50800567 1.53705399 0.29425100E-02 0.94500000E+04 0.97154404 10.61644572 1.53698313 0.35697060E-02 0.95000000E+04 0.96940047 10.72391926 1.53695384 0.42852287E-02 0.95500000E+04 0.96708165 10.83040241 1.53694864 0.50896305E-02 0.96000000E+04 0.96458071 10.93587593 1.53693441 0.59799369E-02 0.96500000E+04 0.96189132 11.04032519 1.53688752 0.69495309E-02 0.97000000E+04 0.95900764 11.14373998 1.53681187 0.79885608E-02 0.97500000E+04 0.95592436 11.24611409 1.53673614 0.90846684E-02 0.98000000E+04 0.95263662 11.34744489 1.53669186 0.10223782E-01 0.98500000E+04 0.94913993 11.44773271 1.53668864 0.11390811E-01 0.99000000E+04 0.94543008 11.54698031 1.53670570 0.12570259E-01 0.99500000E+04 0.94150308 11.64519212 1.53670645 0.13746877E-01 0.10000000E+05 0.93735502 11.74237366 1.53666569 0.14906500E-01 0.10050000E+05 0.93298199 11.83853084 1.53658909 0.16037080E-01 0.10100000E+05 0.92837996 11.93366935 1.53651030 0.17129723E-01 0.10150000E+05 0.92354472 12.02779412 1.53646709 0.18179370E-01 0.10200000E+05 0.91847176 12.12090880 1.53647355 0.19184877E-01 0.10250000E+05 0.91315624 12.21301542 1.53650906 0.20148382E-01 0.10300000E+05 0.90759297 12.30411413 1.53653269 0.21074094E-01 0.10350000E+05 0.90177643 12.39420316 1.53651256 0.21966832E-01 0.10400000E+05 0.89570088 12.48327899 1.53644873 0.22830678E-01 0.10450000E+05 0.88936051 12.57133673 1.53637316 0.23668027E-01 0.10500000E+05 0.88274962 12.65837072 1.53632654 0.24479159E-01 0.10550000E+05 0.87586292 12.74437522 1.53632874 0.25262250E-01 0.10600000E+05 0.86869572 12.82934512 1.53636455 0.26013670E-01 0.10650000E+05 0.86124419 12.91327657 1.53639526 0.26728489E-01 0.10700000E+05 0.85350554 12.99616738 1.53638729 0.27401131E-01 0.10750000E+05 0.84547810 13.07801722 1.53633655 0.28026097E-01 0.10800000E+05 0.83716142 13.15882742 1.53627076 0.28598545E-01 0.10850000E+05 0.82855618 13.23860060 1.53622841 0.29114532E-01 0.10900000E+05 0.81966412 13.31733999 1.53622996 0.29570856E-01 0.10950000E+05 0.81048796 13.39504873 1.53626289 0.29964683E-01 0.11000000E+05 0.80103123 13.47172916 1.53629194 0.30293218E-01 0.11050000E+05 0.79129822 13.54738222 1.53628633 0.30553631E-01 0.11100000E+05 0.78129386 13.62200704 1.53624327 0.30743260E-01 0.11150000E+05 0.77102374 13.69560085 1.53618977 0.30859945E-01 0.11200000E+05 0.76049404 13.76815911 1.53616159 0.30902270E-01 0.11250000E+05 0.74971162 13.83967586 1.53617513 0.30869660E-01 0.11300000E+05 0.73868398 13.91014432 1.53621383 0.30762429E-01 0.11350000E+05 0.72741933 13.97955751 1.53624008 0.30581946E-01 0.11400000E+05 0.71592663 14.04790904 1.53622421 0.30330930E-01 0.11450000E+05 0.70421552 14.11519378 1.53616848 0.30013669E-01 0.11500000E+05 0.69229641 14.18140858 1.53610731 0.29635936E-01 0.11550000E+05 0.68018039 14.24655282 1.53608284 0.29204486E-01 0.11600000E+05 0.66787931 14.31062892 1.53611311 0.28726208E-01 0.11650000E+05 0.65540573 14.37364265 1.53617645 0.28207200E-01 0.11700000E+05 0.64277296 14.43560341 1.53622480 0.27652132E-01 0.11750000E+05 0.62999510 14.49652425 1.53621773 0.27064090E-01 0.11800000E+05 0.61708708 14.55642179 1.53615273 0.26444906E-01 0.11850000E+05 0.60406461 14.61531591 1.53606932 0.25795751E-01 0.11900000E+05 0.59094415 14.67322927 1.53602304 0.25117711E-01 0.11950000E+05 0.57774277 14.73018657 1.53604639 0.24412187E-01 0.12000000E+05 0.56447794 14.78621365 1.53612428 0.23681129E-01 0.12050000E+05 0.55116734 14.84133646 1.53620232 0.22927277E-01 0.12100000E+05 0.53782855 14.89557992 1.53622362 0.22154478E-01 0.12150000E+05 0.52447889 14.94896686 1.53616891 0.21367974E-01 0.12200000E+05 0.51113521 15.00151712 1.53607154 0.20574435E-01 0.12250000E+05 0.49781386 15.05324689 1.53599613 0.19781568E-01 0.12300000E+05 0.48453069 15.10416849 1.53599457 0.18997365E-01 0.12350000E+05 0.47130122 15.15429052 1.53606942 0.18229212E-01 0.12400000E+05 0.45814074 15.20361835 1.53617064 0.17483102E-01 0.12450000E+05 0.44506452 15.25215492 1.53622915 0.16763149E-01 0.12500000E+05 0.43208791 15.29990168 1.53620419 0.16071486E-01 0.12550000E+05 0.41922637 15.34685942 1.53611128 0.15408522E-01 0.12600000E+05 0.40649543 15.39302897 1.53601184 0.14773438E-01 0.12650000E+05 0.39391053 15.43841154 1.53597149 0.14164701E-01 0.12700000E+05 0.38148676 15.48300879 1.53601592 0.13580442E-01 0.12750000E+05 0.36923863 15.52682263 1.53611458 0.13018578E-01 0.12800000E+05 0.35717977 15.56985484 1.53620281 0.12476775E-01 0.12850000E+05 0.34532266 15.61210671 1.53622582 0.11952473E-01 0.12900000E+05 0.33367849 15.65357879 1.53617353 0.11443201E-01 0.12950000E+05 0.32225704 15.69427084 1.53608366 0.10947192E-01 0.13000000E+05 0.31106660 15.73418202 1.53601367 0.10463995E-01 0.13050000E+05 0.30011407 15.77331115 1.53600297 0.99947167E-02 0.13100000E+05 0.28940506 15.81165709 1.53605147 0.95416844E-02 0.13150000E+05 0.27894398 15.84921899 1.53612597 0.91076660E-02 0.13200000E+05 0.26873429 15.88599641 1.53618553 0.86949960E-02 0.13250000E+05 0.25877865 15.92198926 1.53620520 0.83050325E-02 0.13300000E+05 0.24907908 15.95719765 1.53618386 0.79381733E-02 0.13350000E+05 0.23963709 15.99162156 1.53613644 0.75943483E-02 0.13400000E+05 0.23045378 16.02526056 1.53608188 0.72736410E-02 0.13450000E+05 0.22152988 16.05811355 1.53603785 0.69766481E-02 0.13500000E+05 0.21286573 16.09017856 1.53602243 0.67043798E-02 0.13550000E+05 0.20446125 16.12145275 1.53605234 0.64577867E-02 0.13600000E+05 0.19631588 16.15193247 1.53613044 0.62372078E-02 0.13650000E+05 0.18842849 16.18161354 1.53623035 0.60420679E-02 0.13700000E+05 0.18079737 16.21049178 1.53629710 0.58709911E-02 0.13750000E+05 0.17342022 16.23856370 1.53627484 0.57222138E-02 0.13800000E+05 0.16629417 16.26582744 1.53615026 0.55940076E-02 0.13850000E+05 0.15941590 16.29228381 1.53598040 0.54848717E-02 0.13900000E+05 0.15278169 16.31793746 1.53587359 0.53934474E-02 0.13950000E+05 0.14638759 16.34279790 1.53592224 0.53182840E-02 0.14000000E+05 0.14022951 16.36688040 1.53612745 0.52576533E-02 0.14050000E+05 0.13430332 16.39020658 1.53637531 0.52095504E-02 0.14100000E+05 0.12860487 16.41280472 1.53649713 0.51718760E-02 0.14150000E+05 0.12313007 16.43470973 1.53638436 0.51426488E-02 0.14200000E+05 0.11787476 16.45596270 1.53607969 0.51200791E-02 0.14250000E+05 0.11283470 16.47661023 1.53577032 0.51024651E-02 0.14300000E+05 0.10800549 16.49670331 1.53567261 0.50880246E-02 0.14350000E+05 0.10338243 16.51629580 1.53587911 0.50748342E-02 0.14400000E+05 0.09896051 16.53544266 1.53627620 0.50609742E-02 0.14450000E+05 0.09473429 16.55419782 1.53660285 0.50448318E-02 0.14500000E+05 0.09069797 16.57261208 1.53662307 0.50253887E-02 0.14550000E+05 0.08684538 16.59073112 1.53629655 0.50022979E-02 0.14600000E+05 0.08317006 16.60859412 1.53582217 0.49756769E-02 0.14650000E+05 0.07966537 16.62623319 1.53551403 0.49457310E-02 0.14700000E+05 0.07632458 16.64367372 1.53558953 0.49124353E-02 0.14750000E+05 0.07314101 16.66093586 1.53601369 0.48754625E-02 0.14800000E+05 0.07010813 16.67803682 1.53651048 0.48343708E-02 0.14850000E+05 0.06721959 16.69499381 1.53674185 0.47888940E-02 0.14900000E+05 0.06446927 16.71182714 1.53653767 0.47391158E-02 0.14950000E+05 0.06185130 16.72856309 1.53601801 0.46854026E-02 0.15000000E+05 0.05936003 16.74523618 1.53551927 0.46281619E-02 0.15050000E+05 0.05698998 16.76189064 1.53537197 0.45676251E-02 0.15100000E+05 0.05473587 16.77858085 1.53567920 0.45038267E-02 0.15150000E+05 0.05259257 16.79537083 1.53624285 0.44367870E-02 0.15200000E+05 0.05055511 16.81233305 1.53668922 0.43667485E-02 0.15250000E+05 0.04861866 16.82954652 1.53671467 0.42942775E-02 0.15300000E+05 0.04677857 16.84709472 1.53628991 0.42201439E-02 0.15350000E+05 0.04503033 16.86506338 1.53568458 0.41450425E-02 0.15400000E+05 0.04336961 16.88353848 1.53529323 0.40693338E-02 0.15450000E+05 0.04179226 16.90260452 1.53537616 0.39929710E-02 0.15500000E+05 0.04029429 16.92234315 1.53588427 0.39156525E-02 0.15550000E+05 0.03887186 16.94283213 1.53648495 0.38370936E-02 0.15600000E+05 0.03752129 16.96414444 1.53677617 0.37572439E-02 0.15650000E+05 0.03623899 16.98634749 1.53655200 0.36763398E-02 0.15700000E+05 0.03502152 17.00950202 1.53594566 0.35947954E-02 0.15750000E+05 0.03386551 17.03366096 1.53535139 0.35130344E-02 0.15800000E+05 0.03276771 17.05886800 1.53516825 0.34313770E-02 0.15850000E+05 0.03172495 17.08515603 1.53552925 0.33500340E-02 0.15900000E+05 0.03073415 17.11254576 1.53620063 0.32691636E-02 0.15950000E+05 0.02979235 17.14104438 1.53672907 0.31889087E-02 0.16000000E+05 0.02889665 17.17064465 1.53674408 0.31093735E-02 0.16050000E+05 0.02804428 17.20132433 1.53621522 0.30305735E-02 0.16100000E+05 0.02723253 17.23304613 1.53548802 0.29524271E-02 0.16150000E+05 0.02645881 17.26575826 1.53506112 0.28748198E-02 0.16200000E+05 0.02572062 17.29939547 1.53524162 0.27977118E-02 0.16250000E+05 0.02501557 17.33388068 1.53591739 0.27212139E-02 0.16300000E+05 0.02434135 17.36912697 1.53662135 0.26455799E-02 0.16350000E+05 0.02369577 17.40503981 1.53685235 0.25711175E-02 0.16400000E+05 0.02307678 17.44151923 1.53642989 0.24980763E-02 0.16450000E+05 0.02248242 17.47846202 1.53563423 0.24265796E-02 0.16500000E+05 0.02191085 17.51576371 1.53502458 0.23566280E-02 0.16550000E+05 0.02136038 17.55332030 1.53504535 0.22881558E-02 0.16600000E+05 0.02082943 17.59102984 1.53569456 0.22210895E-02 0.16650000E+05 0.02031654 17.62879378 1.53650980 0.21553717E-02 0.16700000E+05 0.01982039 17.66651801 1.53689660 0.20909513E-02 0.16750000E+05 0.01933974 17.70411366 1.53656163 0.20277764E-02 0.16800000E+05 0.01887348 17.74149767 1.53573483 0.19658197E-02 0.16850000E+05 0.01842059 17.77859321 1.53501466 0.19051246E-02 0.16900000E+05 0.01798017 17.81532999 1.53493584 0.18458267E-02 0.16950000E+05 0.01755139 17.85164456 1.53556610 0.17881152E-02 0.17000000E+05 0.01713349 17.88748054 1.53644147 0.17321414E-02 0.17050000E+05 0.01672583 17.92278874 1.53690602 0.16779292E-02 0.17100000E+05 0.01632782 17.95752717 1.53660452 0.16253482E-02 0.17150000E+05 0.01593895 17.99166083 1.53575503 0.15741705E-02 0.17200000E+05 0.01555877 18.02516139 1.53499300 0.15241815E-02 0.17250000E+05 0.01518688 18.05800663 1.53489631 0.14752770E-02 0.17300000E+05 0.01482295 18.09017989 1.53554233 0.14274938E-02 0.17350000E+05 0.01446665 18.12166936 1.53643930 0.13809661E-02 0.17400000E+05 0.01411774 18.15246735 1.53689806 0.13358437E-02 0.17450000E+05 0.01377598 18.18256959 1.53656265 0.12922183E-02 0.17500000E+05 0.01344114 18.21197465 1.53568827 0.12500887E-02 0.17550000E+05 0.01311306 18.24068345 1.53494860 0.12093709E-02 0.17600000E+05 0.01279156 18.26869896 1.53491573 0.11699347E-02 0.17650000E+05 0.01247649 18.29602601 1.53561287 0.11316480E-02 0.17700000E+05 0.01216772 18.32267113 1.53649296 0.10944096E-02 0.17750000E+05 0.01186513 18.34864236 1.53686669 0.10581680E-02 0.17800000E+05 0.01156861 18.37394903 1.53644307 0.10229257E-02 0.17850000E+05 0.01127807 18.39860153 1.53555662 0.98872957E-03 0.17900000E+05 0.01099341 18.42261096 1.53490463 0.95564555E-03 0.17950000E+05 0.01071454 18.44598891 1.53499751 0.92372152E-03 0.18000000E+05 0.01044138 18.46874715 1.53575355 0.89295484E-03 0.18050000E+05 0.01017385 18.49089747 1.53656541 0.86328283E-03 0.18100000E+05 0.00991188 18.51245152 1.53678909 0.83460234E-03 0.18150000E+05 0.00965538 18.53342073 1.53625676 0.80680664E-03 0.18200000E+05 0.00940428 18.55381632 1.53540079 0.77981995E-03 0.18250000E+05 0.00915852 18.57364937 1.53490252 0.75361402E-03 0.18300000E+05 0.00891801 18.59293101 1.53515007 0.72820294E-03 0.18350000E+05 0.00868271 18.61167245 1.53593139 0.70362073E-03 0.18400000E+05 0.00845253 18.62988516 1.53660978 0.67989359E-03 0.18450000E+05 0.00822742 18.64758085 1.53664466 0.65702072E-03 0.18500000E+05 0.00800731 18.66477141 1.53602661 0.63497166E-03 0.18550000E+05 0.00779213 18.68146887 1.53526786 0.61369687E-03 0.18600000E+05 0.00758182 18.69768523 1.53497508 0.59314066E-03 0.18650000E+05 0.00737632 18.71343235 1.53536565 0.57324989E-03 0.18700000E+05 0.00717556 18.72872188 1.53610578 0.55398001E-03 0.18750000E+05 0.00697948 18.74356523 1.53658950 0.53530208E-03 0.18800000E+05 0.00678801 18.75797359 1.53643484 0.51720822E-03 0.18850000E+05 0.00660108 18.77195806 1.53579064 0.49970914E-03 0.18900000E+05 0.00641863 18.78552974 1.53519651 0.48282176E-03 0.18950000E+05 0.00624059 18.79869981 1.53512661 0.46655269E-03 0.19000000E+05 0.00606689 18.81147952 1.53561209 0.45088647E-03 0.19050000E+05 0.00589747 18.82388018 1.53623807 0.43578448E-03 0.19100000E+05 0.00573226 18.83591301 1.53649324 0.42119550E-03 0.19150000E+05 0.00557118 18.84758901 1.53618514 0.40707319E-03 0.19200000E+05 0.00541417 18.85891888 1.53558868 0.39339113E-03 0.19250000E+05 0.00526115 18.86991291 1.53520474 0.38014578E-03 0.19300000E+05 0.00511206 18.88058096 1.53533628 0.36734569E-03 0.19350000E+05 0.00496682 18.89093249 1.53584875 0.35499568E-03 0.19400000E+05 0.00482536 18.90097666 1.53630449 0.34308814E-03 0.19450000E+05 0.00468761 18.91072242 1.53633352 0.33160631E-03 0.19500000E+05 0.00455349 18.92017860 1.53593080 0.32053261E-03 0.19550000E+05 0.00442294 18.92935390 1.53544727 0.30985254E-03 0.19600000E+05 0.00429587 18.93825689 1.53528820 0.29955126E-03 0.19650000E+05 0.00417222 18.94689586 1.53557215 0.28960833E-03 0.19700000E+05 0.00405192 18.95527882 1.53604251 0.27999782E-03 0.19750000E+05 0.00393489 18.96341336 1.53629892 0.27069530E-03 0.19800000E+05 0.00382105 18.97130668 1.53613626 0.26168686E-03 0.19850000E+05 0.00371035 18.97896559 1.53570612 0.25297319E-03 0.19900000E+05 0.00360270 18.98639655 1.53537898 0.24456426E-03 0.19950000E+05 0.00349803 18.99360573 1.53542790 0.23646707E-03 0.20000000E+05 0.00339628 19.00059907 1.53579999 0.22867437E-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 -0.012490 1.58912 2 0.1554312 -0.019132 1.03771 3 0.1597487 -0.013503 0.50912 4 0.1640662 -0.001385 -0.01039 5 0.1683837 0.008584 -0.53398 6 0.1727013 0.010532 -1.06717 7 0.1770188 0.004819 -1.60160 8 0.1813363 -0.002980 -2.11938 9 0.1856539 -0.006706 -2.60907 10 0.1899714 -0.004272 -3.07572 11 0.1942889 0.001259 2.74699 12 0.1986065 0.004801 2.27647 13 0.2029240 0.003692 1.79497 14 0.2072415 -0.000373 1.32150 15 0.2115591 -0.003357 0.87621 16 0.2158766 -0.002725 0.45914 17 0.2201941 0.000466 0.05319 18 0.2245117 0.002930 -0.35765 19 0.2288292 0.002396 -0.77145 20 0.2331467 -0.000370 -1.16911 21 0.2374643 -0.002511 -1.53717 22 0.2417818 -0.001935 -1.88246 23 0.2460993 0.000675 -2.22242 24 0.2504169 0.002566 -2.56651 25 0.2547344 0.001717 -2.90619 26 0.2590519 -0.000972 3.05707 27 0.2633695 -0.002499 2.75898 28 0.2676870 -0.001046 2.46946 29 0.2720045 0.001743 2.17534 30 0.2763221 0.002454 1.87866 31 0.2806396 0.000065 1.59382 32 0.2849571 -0.002470 1.32750 33 0.2892746 -0.001790 1.06973 34 0.2935922 0.001301 0.80696 35 0.2979097 0.002586 0.53992 36 0.3022272 0.000159 0.28330 37 0.3065448 -0.002612 0.04453 38 0.3108623 -0.001662 -0.18650 39 0.3151798 0.001724 -0.42280 40 0.3194974 0.002490 -0.66138 41 0.3238149 -0.000633 -0.88707 42 0.3281324 -0.002914 -1.09579 43 0.3324500 -0.000744 -1.30052 44 0.3367675 0.002539 -1.51209 45 0.3410850 0.001684 -1.72267 46 0.3454026 -0.002009 -1.91791 47 0.3497201 -0.002549 -2.10040 48 0.3540376 0.000993 -2.28586 49 0.3583552 0.002756 -2.47906 50 0.3626727 -0.000232 -2.66562 51 0.3669902 -0.002913 -2.83597 52 0.3713078 -0.000669 -3.00182 53 0.3756253 0.002687 3.10578 54 0.3799428 0.001386 2.92769 55 0.3842604 -0.002207 2.76446 56 0.3885779 -0.001646 2.61313 57 0.3928954 0.002195 2.45523 58 0.3972129 0.002626 2.28857 59 0.4015305 -0.000850 2.13267 60 0.4058480 -0.001598 1.99395 61 0.4101655 0.002103 1.85404 62 0.4144831 0.003946 1.70224 63 0.4188006 0.001253 1.55627 64 0.4231181 -0.000093 1.43054 65 0.4274357 0.003357 1.30938 66 0.4317532 0.006274 1.17568 67 0.4360707 0.004817 1.04342 68 0.4403883 0.003943 0.93206 69 0.4447058 0.007734 0.82726 70 0.4490233 0.011332 0.70418 71 0.4533409 0.010258 0.57348 72 0.4576584 0.009332 0.46407 73 0.4619759 0.013770 0.36764 74 0.4662935 0.019326 0.25575 75 0.4706110 0.020413 0.13659 76 0.4749285 0.020575 0.04219 77 0.4792461 0.025419 -0.03612 78 0.4835636 0.032019 -0.13206 79 0.4878811 0.035004 -0.23859 80 0.4921987 0.036801 -0.31847 81 0.4965162 0.042340 -0.38054 82 0.5008337 0.049422 -0.46344 83 0.5051512 0.053521 -0.55791 84 0.5094688 0.056756 -0.62001 85 0.5137863 0.063417 -0.66259 86 0.5181038 0.071520 -0.73281 87 0.5224214 0.076918 -0.81788 88 0.5267389 0.081279 -0.86438 89 0.5310564 0.088444 -0.89249 90 0.5353740 0.096850 -0.96084 91 0.5396915 0.102745 -1.04465 92 0.5440090 0.107539 -1.07470 93 0.5483266 0.115047 -1.08634 ******************************************************************************** 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 0.1000280E+01 0.1566686E-01 0.4949629E+00 1 0.6725211E-06 0.3978736E-01 0.8690977E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.1129204E-06 0 31 2 -2 0.2613762E-07 0 37 2 -1 0.6135875E-07 0 44 2 0 0.8224226E-07 0 50 2 1 0.3312934E-06 0 56 2 2 0.4220055E-06 0 21 4 -4 0.1823198E-08 0 26 4 -3 0.6079923E-08 0 32 4 -2 0.1383676E-07 0 38 4 -1 0.3965955E-07 0 45 4 0 0.1500974E-06 0 51 4 1 0.4161429E-06 0 57 4 2 0.1243992E-05 0 62 4 3 0.2863263E-05 0 67 4 4 0.1131177E-05 0 13 6 -6 0.4878445E-10 0 17 6 -5 0.4094883E-10 0 22 6 -4 0.3755752E-09 0 27 6 -3 0.6144972E-09 0 33 6 -2 0.8269086E-08 0 39 6 -1 0.8641176E-08 0 46 6 0 0.2121025E-06 0 52 6 1 0.5619619E-06 0 58 6 2 0.6337566E-05 0 63 6 3 0.2287743E-04 0 68 6 4 0.8308408E-04 0 72 6 5 0.1048473E-03 0 76 6 6 0.6536543E-04 0 7 8 -8 0.4189059E-11 0 10 8 -7 0.2890191E-11 0 14 8 -6 0.7643843E-11 0 18 8 -5 0.2053501E-11 0 23 8 -4 0.9922370E-11 0 28 8 -3 0.6352370E-10 0 34 8 -2 0.1328327E-08 0 40 8 -1 0.8794026E-08 0 47 8 0 0.1412855E-06 0 53 8 1 0.3517127E-06 0 59 8 2 0.1178777E-04 0 64 8 3 0.1612215E-03 0 69 8 4 0.4719533E-02 0 73 8 5 0.8381086E-01 0 77 8 6 0.8079306E+00 0 80 8 7 0.9955660E-01 0 83 8 8 0.3798519E-02 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 0.1987928E-07 1 31 2 -2 0.2817268E-09 1 37 2 -1 0.1757746E-08 1 44 2 0 0.1149185E-07 1 50 2 1 0.6104101E-07 1 56 2 2 0.2745019E-06 1 21 4 -4 0.2379986E-12 1 26 4 -3 0.3315878E-12 1 32 4 -2 0.9411823E-11 1 38 4 -1 0.6710595E-09 1 45 4 0 0.7367810E-07 1 51 4 1 0.2284950E-08 1 57 4 2 0.6432375E-07 1 62 4 3 0.9752764E-07 1 67 4 4 0.6507216E-07 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 0.4960455E-09 1 0.3828069E-08 2 0.7236863E-08 3 0.2300520E-07 4 0.1802923E-07 5 0.1539295E-07 6 0.1353570E-07 7 0.1804262E-07 8 0.7072196E-08 9 0.6281486E-08 v, j, mj = 0 2 -2 0 0.2117206E-15 1 0.1806340E-09 2 0.2055498E-08 3 0.1907082E-08 4 0.3903268E-08 5 0.2465693E-08 6 0.3673360E-08 7 0.3905547E-08 8 0.3959787E-08 9 0.4086755E-08 v, j, mj = 0 2 -1 0 0.8773163E-16 1 0.2292789E-08 2 0.4295643E-08 3 0.8376023E-08 4 0.7601814E-08 5 0.6539196E-08 6 0.6079550E-08 7 0.1411391E-07 8 0.7233877E-08 9 0.4825950E-08 v, j, mj = 0 2 0 0 0.1323784E-08 1 0.3089946E-08 2 0.4420315E-08 3 0.1091244E-07 4 0.4494038E-08 5 0.2116039E-07 6 0.2347180E-07 7 0.8090864E-08 8 0.4208319E-08 9 0.1070357E-08 v, j, mj = 0 2 1 0 0.2270141E-16 1 0.2439787E-08 2 0.3885872E-07 3 0.6505291E-07 4 0.3655626E-07 5 0.5750495E-07 6 0.5276624E-07 7 0.5049649E-07 8 0.2223905E-07 9 0.5378983E-08 v, j, mj = 0 2 2 0 0.1999641E-15 1 0.1015547E-08 2 0.5126183E-07 3 0.4351740E-07 4 0.2943943E-07 5 0.1420344E-06 6 0.1106122E-06 7 0.3974451E-07 8 0.2694825E-08 9 0.1685287E-08 v, j, mj = 0 4 -4 0 0.1052154E-15 1 0.1145302E-10 2 0.2477176E-09 3 0.1652587E-09 4 0.1918895E-09 5 0.1260584E-09 6 0.1010962E-09 7 0.3017659E-09 8 0.4537832E-09 9 0.2241753E-09 v, j, mj = 0 4 -3 0 0.1768055E-10 1 0.4168861E-09 2 0.3068744E-09 3 0.3770337E-09 4 0.4100342E-09 5 0.3712378E-09 6 0.5851307E-09 7 0.1561395E-08 8 0.1270246E-08 9 0.7634043E-09 v, j, mj = 0 4 -2 0 0.2403779E-16 1 0.1375616E-08 2 0.1728444E-08 3 0.1077679E-08 4 0.1908992E-08 5 0.1553100E-08 6 0.2185760E-08 7 0.2279764E-08 8 0.1461063E-08 9 0.2663425E-09 v, j, mj = 0 4 -1 0 0.2427927E-15 1 0.1862907E-08 2 0.4596380E-08 3 0.7299671E-08 4 0.5322892E-08 5 0.4831616E-08 6 0.5907398E-08 7 0.5393857E-08 8 0.2641941E-08 9 0.1802883E-08 v, j, mj = 0 4 0 0 0.2875985E-08 1 0.2471660E-07 2 0.2061850E-07 3 0.4198264E-07 4 0.1609809E-07 5 0.1375425E-07 6 0.1217725E-07 7 0.1280925E-07 8 0.4213823E-08 9 0.8509907E-09 v, j, mj = 0 4 1 0 0.1486404E-15 1 0.1217269E-07 2 0.6512285E-07 3 0.1180150E-06 4 0.8932414E-07 5 0.4498328E-07 6 0.4959104E-07 7 0.3125953E-07 8 0.4371198E-08 9 0.1303265E-08 v, j, mj = 0 4 2 0 0.4615107E-15 1 0.4010555E-07 2 0.4767549E-06 3 0.1867916E-06 4 0.1943505E-06 5 0.1216509E-06 6 0.1758318E-06 7 0.4243455E-07 8 0.4702005E-08 9 0.1370377E-08 v, j, mj = 0 4 3 0 0.9473223E-08 1 0.1736206E-06 2 0.7040437E-06 3 0.2178659E-06 4 0.6840845E-06 5 0.4472959E-06 6 0.5140734E-06 7 0.1057131E-06 8 0.5819856E-08 9 0.1272569E-08 v, j, mj = 0 4 4 0 0.4760016E-14 1 0.4990378E-06 2 0.9084498E-07 3 0.9901927E-07 4 0.2309525E-06 5 0.1303455E-06 6 0.5475659E-07 7 0.2410891E-07 8 0.1815522E-08 9 0.2961584E-09 v, j, mj = 0 6 -6 0 0.1013892E-12 1 0.3536732E-13 2 0.1636908E-12 3 0.1879197E-12 4 0.1270691E-11 5 0.3419698E-11 6 0.1262538E-10 7 0.2992927E-10 8 0.1051038E-11 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.2652847E-15 1 0.1193624E-12 2 0.1290042E-11 3 0.2273529E-11 4 0.1632305E-11 5 0.6165626E-11 6 0.1172187E-10 7 0.1669979E-10 8 0.1046049E-11 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.3476926E-15 1 0.7285069E-11 2 0.1096770E-10 3 0.2619618E-10 4 0.2222013E-10 5 0.5585751E-10 6 0.4464882E-10 7 0.2037083E-09 8 0.4691202E-11 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.1250229E-10 1 0.1296382E-10 2 0.7025076E-10 3 0.7683118E-10 4 0.9509137E-10 5 0.1352655E-09 6 0.1194026E-09 7 0.9125150E-10 8 0.9381063E-12 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.1711458E-15 1 0.8939349E-09 2 0.3177105E-09 3 0.3773915E-09 4 0.1028289E-08 5 0.1537710E-08 6 0.1667590E-08 7 0.2432082E-08 8 0.1437808E-10 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.6593780E-16 1 0.5055426E-09 2 0.1689613E-08 3 0.1218577E-08 4 0.8992410E-09 5 0.2841535E-09 6 0.2691893E-08 7 0.1328928E-08 8 0.2322869E-10 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.8496768E-08 1 0.2223399E-07 2 0.3714995E-07 3 0.1760962E-07 4 0.5809206E-07 5 0.2969762E-07 6 0.2365176E-07 7 0.1494249E-07 8 0.2282423E-09 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.9070200E-16 1 0.6351546E-07 2 0.9574421E-07 3 0.2483596E-06 4 0.8594985E-07 5 0.1437589E-07 6 0.4682859E-07 7 0.6955229E-08 8 0.2330464E-09 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.3213000E-14 1 0.2646307E-06 2 0.2109189E-05 3 0.2019742E-05 4 0.1364015E-05 5 0.4129979E-06 6 0.1395020E-06 7 0.2709474E-07 8 0.3953109E-09 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.1668539E-07 1 0.3089805E-05 2 0.1123365E-04 3 0.7138055E-05 4 0.1176674E-05 5 0.9624501E-07 6 0.1150417E-06 7 0.1086071E-07 8 0.4095550E-09 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.8205558E-14 1 0.2575684E-04 2 0.2528567E-04 3 0.2646730E-04 4 0.4284511E-05 5 0.1143413E-05 6 0.1341828E-06 7 0.1161812E-07 8 0.5454375E-09 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.4415983E-15 1 0.4084041E-04 2 0.6382467E-05 3 0.4574636E-04 4 0.1014487E-04 5 0.1625532E-05 6 0.9354576E-07 7 0.1339876E-07 8 0.6699577E-09 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.1451338E-04 1 0.2208703E-04 2 0.2293300E-04 3 0.5006260E-05 4 0.6637958E-06 5 0.1313521E-06 6 0.2383109E-07 7 0.6379350E-08 8 0.4130762E-09 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.1863553E-16 1 0.3372105E-14 2 0.5133118E-13 3 0.1655503E-12 4 0.1595089E-11 5 0.2373698E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.2507146E-16 1 0.2122475E-13 2 0.4559403E-13 3 0.2041800E-12 4 0.1287195E-11 5 0.1331972E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.1793101E-13 1 0.1282296E-12 2 0.2207174E-12 3 0.3235765E-12 4 0.1701294E-11 5 0.5252094E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1240428E-16 1 0.2667596E-13 2 0.5164205E-13 3 0.1647952E-12 4 0.1148228E-11 5 0.6621472E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1224776E-16 1 0.4008695E-13 2 0.3495904E-12 3 0.3003618E-12 4 0.6553903E-11 5 0.2678415E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.4623362E-12 1 0.3542155E-12 2 0.2312205E-11 3 0.3366223E-11 4 0.2321256E-10 5 0.3381616E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1819337E-17 1 0.1648796E-10 2 0.4258331E-10 3 0.1148921E-09 4 0.8365589E-09 5 0.3178045E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.1233473E-18 1 0.9645450E-09 2 0.1460847E-08 3 0.2257625E-08 4 0.1255545E-08 5 0.2855465E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.9319205E-08 1 0.1428768E-07 2 0.3895924E-07 3 0.1754214E-07 4 0.4419901E-07 5 0.1697822E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.5250395E-18 1 0.9370686E-07 2 0.1116340E-06 3 0.4660550E-07 4 0.4097724E-07 5 0.5878911E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.2677243E-16 1 0.2615771E-05 2 0.5470881E-05 3 0.2482006E-05 4 0.9403182E-06 5 0.2787986E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.3825716E-06 1 0.1277229E-04 2 0.1088754E-03 3 0.3779678E-04 4 0.1241191E-05 5 0.1532197E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.2379667E-15 1 0.8732823E-03 2 0.3204564E-02 3 0.6190235E-03 4 0.2230701E-04 5 0.3564173E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.9421018E-17 1 0.3377303E-01 2 0.4459057E-01 3 0.5359020E-02 4 0.8800937E-04 5 0.2354890E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1197656E+00 1 0.4331022E+00 2 0.2415287E+00 3 0.1341242E-01 4 0.1209796E-03 5 0.7211801E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1983783E-16 1 0.2216951E-01 2 0.6573962E-01 3 0.1144035E-01 4 0.2067109E-03 5 0.4030866E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.3186731E-15 1 0.2720337E-04 2 0.2658979E-02 3 0.1073106E-02 4 0.3913721E-04 5 0.9304164E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.1736173E-08 1 0.1155319E-08 2 0.3281519E-08 3 0.1767800E-08 4 0.4312707E-08 5 0.7625760E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.7655083E-17 1 0.1976410E-10 2 0.4125709E-11 3 0.3763187E-10 4 0.2202051E-09 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 0.7534651E-17 1 0.1233747E-09 2 0.1024865E-09 3 0.1812584E-09 4 0.1350626E-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 0.3819594E-08 1 0.8245529E-09 2 0.2541701E-08 3 0.2683624E-08 4 0.1622374E-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 0.4526126E-17 1 0.5730985E-08 2 0.5275348E-08 3 0.1437994E-07 4 0.3565474E-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 2 0 0.1603611E-16 1 0.8353611E-07 2 0.4839309E-07 3 0.3612661E-07 4 0.1064460E-06 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 0.5091365E-19 1 0.6571564E-13 2 0.1722829E-12 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 0.1801719E-13 1 0.6726818E-13 2 0.2463025E-12 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 0.3668126E-18 1 0.3338434E-11 2 0.6073389E-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 4 -1 0 0.3083468E-19 1 0.2348268E-09 2 0.4362327E-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 0 0 0.1585184E-07 1 0.4275535E-07 2 0.1507091E-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 0.2104659E-18 1 0.5959262E-09 2 0.1689024E-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 0.1448419E-18 1 0.3485016E-07 2 0.2947359E-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 0.5275472E-09 1 0.8475673E-07 2 0.1224336E-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 4 0 0.2501548E-18 1 0.5545352E-07 2 0.9618635E-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 sum of the probabilities = 1.0002805 average vibrational energy (ev) = 0.000000 average rotational energy (ev) = 0.494963 average diffraction energy (ev) = 0.015667 the reaction probability = -0.2804912D-03 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.41272524D+01 trans energy = 0.26428571D+00 trans energy in z = 0.26428571D+00 total momentum = 0.84480953D+01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.1002188E+01 0.2536720E-01 0.4948159E+00 1 0.2171539E-05 0.3600274E-01 0.1065738E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.2660127E-06 0 31 2 -2 0.5622644E-07 0 37 2 -1 0.1589491E-06 0 44 2 0 0.1942007E-06 0 50 2 1 0.9669146E-06 0 56 2 2 0.8183020E-06 0 21 4 -4 0.4668670E-08 0 26 4 -3 0.1069724E-07 0 32 4 -2 0.3033086E-07 0 38 4 -1 0.1401345E-06 0 45 4 0 0.7065227E-06 0 51 4 1 0.1515654E-05 0 57 4 2 0.4304291E-05 0 62 4 3 0.8241653E-05 0 67 4 4 0.3843764E-05 0 13 6 -6 0.1222691E-09 0 17 6 -5 0.1992571E-09 0 22 6 -4 0.6315815E-09 0 27 6 -3 0.1764041E-08 0 33 6 -2 0.1208724E-07 0 39 6 -1 0.3784225E-07 0 46 6 0 0.5826941E-06 0 52 6 1 0.4329580E-05 0 58 6 2 0.2833726E-04 0 63 6 3 0.1361985E-03 0 68 6 4 0.2337662E-03 0 72 6 5 0.4250414E-03 0 76 6 6 0.1675815E-03 0 7 8 -8 0.1108629E-10 0 10 8 -7 0.8617668E-11 0 14 8 -6 0.9124632E-11 0 18 8 -5 0.6160563E-11 0 23 8 -4 0.1979719E-10 0 28 8 -3 0.2652804E-09 0 34 8 -2 0.2099336E-08 0 40 8 -1 0.2300356E-07 0 47 8 0 0.2000228E-06 0 53 8 1 0.1344302E-05 0 59 8 2 0.3598231E-04 0 64 8 3 0.7833690E-03 0 69 8 4 0.1422085E-01 0 73 8 5 0.1533306E+00 0 77 8 6 0.6038967E+00 0 80 8 7 0.1990699E+00 0 83 8 8 0.2983081E-01 0 3 10 -10 0.3319666E-13 0 5 10 -9 0.4434350E-14 0 8 10 -8 0.4899741E-14 0 11 10 -7 0.1714715E-13 0 15 10 -6 0.2070133E-13 0 19 10 -5 0.1667158E-13 0 24 10 -4 0.5222443E-14 0 29 10 -3 0.3239691E-13 0 35 10 -2 0.9780862E-12 0 41 10 -1 0.2066420E-10 0 48 10 0 0.3045403E-09 0 54 10 1 0.3774192E-10 0 60 10 2 0.6201622E-09 0 65 10 3 0.2687916E-08 0 70 10 4 0.6457344E-07 0 74 10 5 0.1630195E-06 0 78 10 6 0.3688487E-06 0 81 10 7 0.4141767E-06 0 84 10 8 0.2058959E-06 0 86 10 9 0.1045962E-07 0 88 10 10 0.6887602E-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 0.4907714E-07 1 31 2 -2 0.3998847E-08 1 37 2 -1 0.3968594E-08 1 44 2 0 0.4365034E-07 1 50 2 1 0.1053958E-06 1 56 2 2 0.5625878E-06 1 21 4 -4 0.7105651E-11 1 26 4 -3 0.2343227E-10 1 32 4 -2 0.1275729E-09 1 38 4 -1 0.4491563E-08 1 45 4 0 0.4881015E-07 1 51 4 1 0.2448464E-07 1 57 4 2 0.3347013E-06 1 62 4 3 0.2460041E-06 1 67 4 4 0.7442110E-06 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 0.5146133E-08 1 0.1230527E-07 2 0.1492283E-07 3 0.8879360E-07 4 0.6905950E-07 5 0.2201472E-07 6 0.2377100E-07 7 0.1452654E-07 8 0.1180374E-07 9 0.3669375E-08 v, j, mj = 0 2 -2 0 0.2379330E-14 1 0.2617317E-08 2 0.4559435E-08 3 0.5735004E-08 4 0.1577035E-07 5 0.5195739E-08 6 0.9956597E-08 7 0.5277673E-08 8 0.4109170E-08 9 0.3005159E-08 v, j, mj = 0 2 -1 0 0.9767546E-15 1 0.3812916E-08 2 0.1198779E-08 3 0.4695235E-07 4 0.4685891E-07 5 0.1622724E-07 6 0.1787205E-07 7 0.1452323E-07 8 0.6979427E-08 9 0.4524167E-08 v, j, mj = 0 2 0 0 0.2168427E-08 1 0.4331145E-08 2 0.1182503E-07 3 0.4457188E-07 4 0.2384833E-07 5 0.2118460E-07 6 0.6077596E-07 7 0.2068743E-07 8 0.2982437E-08 9 0.1825417E-08 v, j, mj = 0 2 1 0 0.2476435E-15 1 0.3382094E-07 2 0.2457818E-06 3 0.3580328E-06 4 0.1069872E-06 5 0.3847037E-07 6 0.7964120E-07 7 0.8143831E-07 8 0.1583838E-07 9 0.6903607E-08 v, j, mj = 0 2 2 0 0.2487842E-14 1 0.2190143E-07 2 0.3512591E-06 3 0.1047955E-06 4 0.1462732E-06 5 0.9037829E-07 6 0.5882150E-07 7 0.3529765E-07 8 0.6882542E-08 9 0.2692789E-08 v, j, mj = 0 4 -4 0 0.3679747E-14 1 0.4425853E-09 2 0.1162522E-08 3 0.7689849E-09 4 0.3755936E-09 5 0.3432475E-09 6 0.4180126E-09 7 0.2370684E-09 8 0.3988859E-09 9 0.5217660E-09 v, j, mj = 0 4 -3 0 0.1259518E-09 1 0.1882611E-08 2 0.1039908E-08 3 0.2165205E-08 4 0.9668206E-09 5 0.6531409E-09 6 0.5395078E-09 7 0.1460708E-08 8 0.1003058E-08 9 0.8603273E-09 v, j, mj = 0 4 -2 0 0.1963301E-15 1 0.5302021E-08 2 0.1263624E-08 3 0.3599696E-08 4 0.1065250E-07 5 0.1720828E-08 6 0.1957091E-08 7 0.3253358E-08 8 0.1805893E-08 9 0.7758475E-09 v, j, mj = 0 4 -1 0 0.1860956E-14 1 0.7708521E-08 2 0.5791276E-08 3 0.5887263E-07 4 0.3608260E-07 5 0.1183577E-07 6 0.9405097E-08 7 0.7227964E-08 8 0.2024754E-08 9 0.1185837E-08 v, j, mj = 0 4 0 0 0.2373211E-07 1 0.5981246E-08 2 0.1216199E-06 3 0.4014000E-06 4 0.9511311E-07 5 0.3206817E-07 6 0.8385970E-08 7 0.1385191E-07 8 0.2949954E-08 9 0.1420259E-08 v, j, mj = 0 4 1 0 0.1040291E-14 1 0.1661445E-07 2 0.3103389E-06 3 0.7292344E-06 4 0.2220354E-06 5 0.1367487E-06 6 0.5250008E-07 7 0.4037580E-07 8 0.6493756E-08 9 0.1312656E-08 v, j, mj = 0 4 2 0 0.5018042E-14 1 0.1997827E-06 2 0.2274623E-05 3 0.9045804E-06 4 0.3173066E-06 5 0.1822232E-06 6 0.3753415E-06 7 0.3898782E-07 8 0.8905251E-08 9 0.2540736E-08 v, j, mj = 0 4 3 0 0.3512006E-08 1 0.1154929E-05 2 0.5451087E-05 3 0.2253705E-06 4 0.4262180E-06 5 0.4948440E-06 6 0.3874650E-06 7 0.7322667E-07 8 0.2033560E-07 9 0.4664114E-08 v, j, mj = 0 4 4 0 0.6315821E-13 1 0.1445991E-05 2 0.3447195E-06 3 0.7847800E-06 4 0.5333028E-06 5 0.3651440E-06 6 0.3134114E-06 7 0.4848794E-07 8 0.7028408E-08 9 0.8992144E-09 v, j, mj = 0 6 -6 0 0.6815338E-12 1 0.2767473E-11 2 0.4143268E-11 3 0.3426842E-11 4 0.6144132E-11 5 0.1069931E-10 6 0.1150366E-10 7 0.5114708E-10 8 0.3175585E-10 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.4439343E-14 1 0.5056061E-12 2 0.2207512E-10 3 0.8853748E-11 4 0.7992839E-11 5 0.1240642E-10 6 0.2345976E-10 7 0.5577937E-10 8 0.6817976E-10 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.5267763E-14 1 0.1847332E-10 2 0.2563455E-10 3 0.7177503E-10 4 0.6230356E-10 5 0.1027429E-09 6 0.1091992E-09 7 0.1905420E-09 8 0.5090568E-10 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.2451415E-10 1 0.9384077E-10 2 0.3029398E-09 3 0.2721378E-09 4 0.2427750E-09 5 0.2369565E-09 6 0.2384075E-09 7 0.3027753E-09 8 0.4969462E-10 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.1679566E-14 1 0.3032740E-08 2 0.6593262E-09 3 0.1472426E-08 4 0.1207082E-08 5 0.2159807E-08 6 0.2031044E-08 7 0.1216961E-08 8 0.3078530E-09 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.5952665E-15 1 0.1478535E-09 2 0.4282981E-08 3 0.1494435E-07 4 0.1058992E-07 5 0.2232881E-08 6 0.3278299E-08 7 0.1329161E-08 8 0.1036799E-08 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.1321087E-07 1 0.1511017E-07 2 0.1503003E-06 3 0.1930243E-06 4 0.1611273E-06 5 0.2337263E-07 6 0.1879775E-07 7 0.5237314E-08 8 0.2513345E-08 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.1652537E-14 1 0.1876016E-07 2 0.1287420E-05 3 0.2303408E-05 4 0.5737605E-06 5 0.7524584E-07 6 0.4530451E-07 7 0.1930373E-07 8 0.6377293E-08 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.5674649E-13 1 0.2169509E-05 2 0.1068693E-04 3 0.1200409E-04 4 0.2882706E-05 5 0.4908668E-06 6 0.8376538E-07 7 0.1373925E-07 8 0.5647168E-08 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.2305599E-07 1 0.1259859E-04 2 0.7768582E-04 3 0.3702511E-04 4 0.8139155E-05 5 0.4607393E-06 6 0.2081358E-06 7 0.3918555E-07 8 0.1874009E-07 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.8104994E-13 1 0.8471291E-04 2 0.3933784E-04 3 0.7876102E-04 4 0.2961741E-04 5 0.1100613E-05 6 0.2007851E-06 7 0.2704965E-07 8 0.8619930E-08 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.6480566E-14 1 0.2155290E-03 2 0.4307470E-04 3 0.1125451E-03 4 0.4842036E-04 5 0.5155459E-05 6 0.2673922E-06 7 0.2984622E-07 8 0.1955314E-07 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.6630258E-04 1 0.2442652E-04 2 0.4510302E-04 3 0.1890270E-04 4 0.6698066E-05 5 0.5709923E-05 6 0.4158933E-06 7 0.1611365E-07 8 0.6641942E-08 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.2681969E-14 1 0.7785241E-13 2 0.5139247E-12 3 0.7669108E-12 4 0.1668271E-11 5 0.4443472E-11 6 0.3613179E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.3727956E-14 1 0.1054964E-12 2 0.5596500E-12 3 0.9903579E-12 4 0.1907889E-11 5 0.2809609E-11 6 0.2240938E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.2913909E-12 1 0.6497281E-12 2 0.2438241E-12 3 0.4957594E-12 4 0.1488464E-11 5 0.5123362E-11 6 0.8321029E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.9329960E-15 1 0.5178053E-13 2 0.2712576E-12 3 0.1658150E-12 4 0.3492293E-12 5 0.1819217E-11 6 0.3502331E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.5105574E-15 1 0.2815560E-12 2 0.1135707E-11 3 0.7534309E-12 4 0.4770897E-11 5 0.4033407E-11 6 0.8821680E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.9886721E-12 1 0.7055552E-11 2 0.6452454E-11 3 0.4305509E-11 4 0.4003032E-10 5 0.1374857E-09 6 0.6896221E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.6252733E-16 1 0.1464541E-09 2 0.3768794E-10 3 0.5343626E-09 4 0.8855426E-09 5 0.1567901E-09 6 0.3384983E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.2451145E-17 1 0.1547282E-08 2 0.1932787E-08 3 0.8491676E-08 4 0.1546295E-08 5 0.7605646E-08 6 0.1879877E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.1735160E-07 1 0.2607998E-07 2 0.4225665E-07 3 0.5034861E-07 4 0.5006381E-07 5 0.7000180E-08 6 0.6921928E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.2778986E-16 1 0.2131258E-06 2 0.4052989E-06 3 0.4044856E-06 4 0.1603281E-06 5 0.1426185E-06 6 0.1844536E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.2967776E-14 1 0.3351712E-05 2 0.1491833E-04 3 0.1615447E-04 4 0.1386970E-05 5 0.1078649E-06 6 0.6296760E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.5116728E-06 1 0.2821265E-04 2 0.4341095E-03 3 0.2990110E-03 4 0.2088039E-04 5 0.5991752E-06 6 0.4463385E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.2089597E-13 1 0.5650362E-03 2 0.9602578E-02 3 0.3829083E-02 4 0.2230207E-03 5 0.1046615E-05 6 0.8239610E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.8291847E-15 1 0.3189382E-01 2 0.9721273E-01 3 0.2332647E-01 4 0.8920078E-03 5 0.5475461E-05 6 0.5851408E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1586536E+00 1 0.1356059E+00 2 0.2740903E+00 3 0.3462607E-01 4 0.9121748E-03 5 0.8636144E-05 6 0.1046344E-06 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.2137745E-14 1 0.2439035E-02 2 0.1232303E+00 3 0.6941674E-01 4 0.3958828E-02 5 0.2487468E-04 6 0.7756378E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.4393454E-13 1 0.1498209E-02 2 0.1243253E-01 3 0.1443319E-01 4 0.1456038E-02 5 0.1081775E-04 6 0.2048139E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.4856528E-19 1 0.3214705E-13 2 0.1049563E-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 0.7082541E-16 1 0.3077800E-14 2 0.1285724E-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 0.1969197E-18 1 0.4624921E-14 2 0.2746233E-15 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 0.2231365E-19 1 0.1703910E-13 2 0.1080195E-15 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 0.3602585E-14 1 0.1702957E-13 2 0.6917384E-16 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 0.1430695E-19 1 0.1588004E-13 2 0.7915233E-15 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 0.1965558E-19 1 0.5102659E-14 2 0.1197642E-15 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 0.5720961E-14 1 0.2467791E-13 2 0.1998045E-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 -2 0 0.3034603E-19 1 0.8934132E-12 2 0.8467288E-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 -1 0 0.8488984E-20 1 0.2010557E-10 2 0.5586387E-12 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 0.1403459E-09 1 0.1635015E-09 2 0.6929654E-12 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 0.1593925E-19 1 0.3014311E-10 2 0.7598807E-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 0.1125956E-18 1 0.5784833E-09 2 0.4167891E-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 0.1161624E-08 1 0.1489272E-08 2 0.3702104E-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 4 0 0.7143769E-19 1 0.6377986E-07 2 0.7935807E-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 5 0 0.7996236E-20 1 0.1617103E-06 2 0.1309192E-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 = 0 10 6 0 0.1700289E-06 1 0.1980853E-06 2 0.7345308E-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 7 0 0.4924323E-19 1 0.4105438E-06 2 0.3632938E-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 = 0 10 8 0 0.1088653E-18 1 0.2054258E-06 2 0.4701187E-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 9 0 0.1413817E-08 1 0.8805401E-08 2 0.2404060E-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 10 0 0.1262750E-18 1 0.6286451E-08 2 0.6011514E-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 0 0 0 0.4330664E-08 1 0.1290333E-07 2 0.1053593E-07 3 0.3896387E-08 4 0.5027043E-08 5 0.7574160E-08 6 0.4809621E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.2225958E-14 1 0.7768667E-10 2 0.1671029E-09 3 0.5491296E-10 4 0.5760600E-09 5 0.3123083E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.6588978E-15 1 0.1703412E-08 2 0.2799559E-09 3 0.4222698E-09 4 0.6951618E-09 5 0.8677940E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.6723455E-08 1 0.3460314E-08 2 0.4231475E-08 3 0.1096138E-08 4 0.7448680E-08 5 0.2069028E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.5531666E-15 1 0.1301550E-07 2 0.1050573E-07 3 0.5079432E-07 4 0.1847916E-07 5 0.1260112E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.3894147E-14 1 0.1733180E-06 2 0.1655924E-06 3 0.4201468E-07 4 0.4859416E-07 5 0.1330686E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.3479328E-17 1 0.1114829E-12 2 0.4856315E-12 3 0.4854204E-11 4 0.1654329E-11 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 0.6032468E-13 1 0.2383767E-12 2 0.4263532E-11 3 0.1275234E-10 4 0.6117692E-11 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 0.3915130E-16 1 0.2137378E-10 2 0.4281516E-11 3 0.8327307E-10 4 0.1864448E-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 4 -1 0 0.2884835E-16 1 0.5746611E-09 2 0.1973200E-08 3 0.1903871E-08 4 0.3983129E-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 4 0 0 0.5425442E-08 1 0.2630879E-07 2 0.1159009E-07 3 0.5374724E-08 4 0.1111006E-09 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 0.2598055E-16 1 0.3242999E-08 2 0.7907783E-08 3 0.1302537E-07 4 0.3084819E-09 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 0.1381362E-15 1 0.2524079E-06 2 0.6657063E-07 3 0.1427491E-07 4 0.1447928E-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 0.3553228E-08 1 0.6010520E-07 2 0.1083272E-06 3 0.7272268E-07 4 0.1295783E-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 0.4368978E-16 1 0.5751869E-06 2 0.1382097E-06 3 0.2465697E-07 4 0.6157385E-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 = 1.0021903 average vibrational energy (ev) = 0.000001 average rotational energy (ev) = 0.494815 average diffraction energy (ev) = 0.025367 the reaction probability = -0.2190310D-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 0.9988907E+00 0.3619530E-01 0.4944124E+00 1 0.1636943E-04 0.2493999E-01 0.1344286E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.1738297E-05 0 31 2 -2 0.3263027E-06 0 37 2 -1 0.8996438E-06 0 44 2 0 0.6464776E-06 0 50 2 1 0.5325285E-05 0 56 2 2 0.4621562E-05 0 21 4 -4 0.1375640E-06 0 26 4 -3 0.1069989E-06 0 32 4 -2 0.3562022E-06 0 38 4 -1 0.1065973E-05 0 45 4 0 0.5325012E-05 0 51 4 1 0.7267513E-05 0 57 4 2 0.1603256E-04 0 62 4 3 0.3907396E-04 0 67 4 4 0.2031792E-04 0 13 6 -6 0.3301590E-08 0 17 6 -5 0.2855713E-08 0 22 6 -4 0.3353251E-08 0 27 6 -3 0.6830807E-08 0 33 6 -2 0.5734013E-07 0 39 6 -1 0.4934586E-06 0 46 6 0 0.4535018E-05 0 52 6 1 0.3534901E-04 0 58 6 2 0.1632165E-03 0 63 6 3 0.4893336E-03 0 68 6 4 0.6306356E-03 0 72 6 5 0.1138868E-02 0 76 6 6 0.3985367E-03 0 7 8 -8 0.3694507E-10 0 10 8 -7 0.2264868E-10 0 14 8 -6 0.3056075E-10 0 18 8 -5 0.2513205E-10 0 23 8 -4 0.8569700E-10 0 28 8 -3 0.5450158E-09 0 34 8 -2 0.4944037E-08 0 40 8 -1 0.4577806E-07 0 47 8 0 0.4296968E-06 0 53 8 1 0.8230505E-05 0 59 8 2 0.1945779E-03 0 64 8 3 0.3683248E-02 0 69 8 4 0.4075319E-01 0 73 8 5 0.2130292E+00 0 77 8 6 0.3789074E+00 0 80 8 7 0.2391413E+00 0 83 8 8 0.1202044E+00 0 3 10 -10 0.2357674E-11 0 5 10 -9 0.4920903E-12 0 8 10 -8 0.8138058E-12 0 11 10 -7 0.6791886E-12 0 15 10 -6 0.7769974E-12 0 19 10 -5 0.7098871E-12 0 24 10 -4 0.7548411E-12 0 29 10 -3 0.1196389E-10 0 35 10 -2 0.1091968E-09 0 41 10 -1 0.3056658E-09 0 48 10 0 0.2536572E-08 0 54 10 1 0.8728786E-08 0 60 10 2 0.2415319E-07 0 65 10 3 0.2228734E-06 0 70 10 4 0.4293543E-06 0 74 10 5 0.5999252E-06 0 78 10 6 0.8804766E-06 0 81 10 7 0.6703691E-06 0 84 10 8 0.6617273E-06 0 86 10 9 0.2341679E-06 0 88 10 10 0.6451886E-06 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 0.4795688E-07 1 31 2 -2 0.2438110E-08 1 37 2 -1 0.1100387E-07 1 44 2 0 0.4023634E-07 1 50 2 1 0.2957252E-06 1 56 2 2 0.1092603E-05 1 21 4 -4 0.8030410E-10 1 26 4 -3 0.6568659E-10 1 32 4 -2 0.3849217E-09 1 38 4 -1 0.6134037E-08 1 45 4 0 0.2768781E-07 1 51 4 1 0.2181759E-07 1 57 4 2 0.1693067E-06 1 62 4 3 0.1178856E-05 1 67 4 4 0.1338444E-04 1 13 6 -6 0.4110737E-12 1 17 6 -5 0.1418982E-12 1 22 6 -4 0.1482894E-13 1 27 6 -3 0.2386504E-12 1 33 6 -2 0.4686500E-11 1 39 6 -1 0.2817022E-09 1 46 6 0 0.1331885E-08 1 52 6 1 0.1430184E-09 1 58 6 2 0.4635079E-08 1 63 6 3 0.1087866E-08 1 68 6 4 0.1127578E-07 1 72 6 5 0.2216088E-07 1 76 6 6 0.4977000E-07 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 0.4994577E-07 1 0.1454819E-07 2 0.1074185E-06 3 0.7250700E-06 4 0.4869172E-06 5 0.1945603E-06 6 0.9586387E-07 7 0.4648812E-07 8 0.1176824E-07 9 0.5716891E-08 v, j, mj = 0 2 -2 0 0.2611909E-13 1 0.2260562E-07 2 0.3352749E-07 3 0.4942371E-07 4 0.1158413E-06 5 0.5602221E-07 6 0.2751101E-07 7 0.1397099E-07 8 0.3929605E-08 9 0.3470696E-08 v, j, mj = 0 2 -1 0 0.4983877E-14 1 0.2660276E-07 2 0.3608630E-07 3 0.3395150E-06 4 0.3566449E-06 5 0.7135577E-07 6 0.3875703E-07 7 0.2042562E-07 8 0.7004830E-08 9 0.3251611E-08 v, j, mj = 0 2 0 0 0.1858755E-07 1 0.6824585E-07 2 0.2911647E-07 3 0.1807901E-06 4 0.1736840E-06 5 0.3528870E-07 6 0.1081111E-06 7 0.2808838E-07 8 0.2660303E-08 9 0.1905183E-08 v, j, mj = 0 2 1 0 0.8240132E-15 1 0.2490942E-06 2 0.1020153E-05 3 0.2639240E-05 4 0.9280555E-06 5 0.2249704E-06 6 0.1078578E-06 7 0.1349642E-06 8 0.1501094E-07 9 0.5938170E-08 v, j, mj = 0 2 2 0 0.1860792E-13 1 0.2197461E-06 2 0.1643111E-05 3 0.6102750E-06 4 0.9770506E-06 5 0.7133172E-06 6 0.3176765E-06 7 0.8821421E-07 8 0.4666089E-07 9 0.5510437E-08 v, j, mj = 0 4 -4 0 0.2052978E-13 1 0.2155142E-07 2 0.2452403E-07 3 0.3763195E-07 4 0.3089355E-07 5 0.1550330E-07 6 0.4723651E-08 7 0.8415882E-09 8 0.8528671E-09 9 0.1041582E-08 v, j, mj = 0 4 -3 0 0.4280918E-09 1 0.1427143E-07 2 0.2247218E-07 3 0.3631000E-07 4 0.2016164E-07 5 0.7019708E-08 6 0.3180582E-08 7 0.1214575E-08 8 0.1322833E-08 9 0.6179008E-09 v, j, mj = 0 4 -2 0 0.1971922E-16 1 0.8684784E-07 2 0.1316654E-07 3 0.9413457E-07 4 0.1363030E-06 5 0.1306249E-07 6 0.4611933E-08 7 0.4977684E-08 8 0.1986069E-08 9 0.1112006E-08 v, j, mj = 0 4 -1 0 0.9442936E-14 1 0.6552541E-07 2 0.7384829E-07 3 0.6039776E-06 4 0.2622984E-06 5 0.2539253E-07 6 0.1934913E-07 7 0.1258022E-07 8 0.1658920E-08 9 0.1342466E-08 v, j, mj = 0 4 0 0 0.3074600E-06 1 0.3529987E-07 2 0.1191883E-05 3 0.3202547E-05 4 0.4711056E-06 5 0.7257554E-07 6 0.2129568E-07 7 0.1555062E-07 8 0.6090691E-08 9 0.1203810E-08 v, j, mj = 0 4 1 0 0.1801593E-14 1 0.2809282E-06 2 0.2471170E-05 3 0.3685808E-05 4 0.4879926E-06 5 0.2048678E-06 6 0.7055670E-07 7 0.5995030E-07 8 0.4187766E-08 9 0.2051064E-08 v, j, mj = 0 4 2 0 0.3896682E-13 1 0.1431963E-05 2 0.9751978E-05 3 0.2469044E-05 4 0.1415830E-05 5 0.5368096E-06 6 0.3490733E-06 7 0.6213449E-07 8 0.1224800E-07 9 0.3474425E-08 v, j, mj = 0 4 3 0 0.3655800E-07 1 0.4498228E-05 2 0.2847545E-04 3 0.1476376E-05 4 0.2346200E-05 5 0.1695003E-05 6 0.4355400E-06 7 0.9372529E-07 8 0.1006102E-07 9 0.6817797E-08 v, j, mj = 0 4 4 0 0.2916363E-12 1 0.5048061E-05 2 0.1044075E-05 3 0.5641199E-05 4 0.1484040E-05 5 0.4060521E-05 6 0.2489342E-05 7 0.5306802E-06 8 0.1530827E-07 9 0.4694911E-08 v, j, mj = 0 6 -6 0 0.2329243E-09 1 0.2644508E-09 2 0.6661198E-09 3 0.8643771E-09 4 0.7653457E-09 5 0.3490356E-09 6 0.4584710E-10 7 0.3237488E-10 8 0.7704524E-10 9 0.4069522E-11 v, j, mj = 0 6 -5 0 0.1442529E-13 1 0.9637420E-10 2 0.1035662E-08 3 0.7856649E-09 4 0.4741393E-09 5 0.2054398E-09 6 0.8897454E-10 7 0.1079710E-09 8 0.5282772E-10 9 0.8644866E-11 v, j, mj = 0 6 -4 0 0.1519641E-13 1 0.6487900E-09 2 0.1333050E-08 3 0.3786382E-09 4 0.2805318E-09 5 0.2206720E-09 6 0.1939920E-09 7 0.1517656E-09 8 0.1289568E-09 9 0.1683916E-10 v, j, mj = 0 6 -3 0 0.5980955E-11 1 0.7976680E-09 2 0.8042352E-09 3 0.2429862E-08 4 0.1146950E-08 5 0.5446484E-09 6 0.4361803E-09 7 0.4690483E-09 8 0.1797207E-09 9 0.1651202E-10 v, j, mj = 0 6 -2 0 0.1548087E-13 1 0.1082613E-07 2 0.8516576E-08 3 0.1977988E-07 4 0.1125120E-07 5 0.3166329E-08 6 0.2156208E-08 7 0.6366701E-09 8 0.9752987E-09 9 0.3181112E-10 v, j, mj = 0 6 -1 0 0.3975554E-14 1 0.8938503E-08 2 0.3534567E-07 3 0.2803073E-06 4 0.1414706E-06 5 0.1979633E-07 6 0.3994097E-08 7 0.2169420E-08 8 0.1374518E-08 9 0.6208820E-10 v, j, mj = 0 6 0 0 0.1294891E-06 1 0.3908087E-07 2 0.9434877E-06 3 0.2302478E-05 4 0.1023171E-05 5 0.7935682E-07 6 0.1089501E-07 7 0.3517800E-08 8 0.3436354E-08 9 0.1057036E-09 v, j, mj = 0 6 1 0 0.2082365E-13 1 0.2024821E-06 2 0.1284354E-04 3 0.1828201E-04 4 0.3674622E-05 5 0.2880306E-06 6 0.2964624E-07 7 0.2316765E-07 8 0.5239875E-08 9 0.2638215E-09 v, j, mj = 0 6 2 0 0.5049326E-12 1 0.7520205E-05 2 0.7464911E-04 3 0.7017209E-04 4 0.9789325E-05 5 0.1020910E-05 6 0.4983715E-07 7 0.1008502E-07 8 0.4755077E-08 9 0.1741365E-09 v, j, mj = 0 6 3 0 0.1938234E-06 1 0.5662645E-04 2 0.2884152E-03 3 0.1135834E-03 4 0.2707118E-04 5 0.2952767E-05 6 0.4008993E-06 7 0.6910926E-07 8 0.2055167E-07 9 0.2804780E-09 v, j, mj = 0 6 4 0 0.1647598E-12 1 0.2676773E-03 2 0.7413303E-04 3 0.1708810E-03 4 0.1082691E-03 5 0.9130242E-05 6 0.4763657E-06 7 0.5834868E-07 8 0.9538779E-08 9 0.5793230E-09 v, j, mj = 0 6 5 0 0.1535025E-13 1 0.5366906E-03 2 0.3139793E-03 3 0.1456059E-03 4 0.1292528E-03 5 0.1266630E-04 6 0.5794617E-06 7 0.6048604E-07 8 0.3181152E-07 9 0.1408820E-08 v, j, mj = 0 6 6 0 0.1865150E-03 1 0.2551854E-04 2 0.1329759E-04 3 0.1213842E-04 4 0.7410916E-04 5 0.7630442E-04 6 0.1041837E-04 7 0.2251416E-06 8 0.9465289E-08 9 0.5564715E-09 v, j, mj = 0 8 -8 0 0.3771074E-13 1 0.4512084E-12 2 0.2433049E-11 3 0.2915410E-11 4 0.3502738E-11 5 0.7994501E-11 6 0.1740326E-10 7 0.2207187E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.3923551E-13 1 0.1573252E-11 2 0.2111143E-11 3 0.1213548E-11 4 0.2773729E-11 5 0.2082477E-11 6 0.8182823E-11 7 0.4672469E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.8392614E-12 1 0.8952774E-12 2 0.1499442E-11 3 0.2681622E-11 4 0.2664180E-11 5 0.4134521E-11 6 0.1645432E-10 7 0.1392130E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.6994691E-14 1 0.9386389E-12 2 0.5419003E-12 3 0.2382486E-11 4 0.1539481E-11 5 0.6183672E-11 6 0.1192219E-10 7 0.1616688E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.4259459E-14 1 0.4211593E-11 2 0.5661347E-11 3 0.8974691E-11 4 0.9900347E-11 5 0.4496106E-11 6 0.4889341E-10 7 0.3555241E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.1101931E-11 1 0.3335487E-10 2 0.5982518E-10 3 0.5968487E-10 4 0.9422430E-10 5 0.1825649E-09 6 0.1039931E-09 7 0.1026667E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1028500E-14 1 0.3533124E-09 2 0.1780796E-09 3 0.1569248E-08 4 0.1289346E-08 5 0.5035130E-09 6 0.9859837E-09 7 0.6455231E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.1235212E-15 1 0.8575766E-08 2 0.6438825E-08 3 0.1676254E-07 4 0.4625636E-08 5 0.5919555E-08 6 0.3286053E-08 7 0.1696826E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.2878063E-07 1 0.7528488E-07 2 0.3614954E-07 3 0.1455983E-06 4 0.1144057E-06 5 0.1045056E-07 6 0.1861661E-07 7 0.4105972E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.9638313E-15 1 0.4470947E-06 2 0.2418535E-05 3 0.4076690E-05 4 0.1145279E-05 5 0.1180463E-06 6 0.2316578E-07 7 0.1693948E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.8838454E-13 1 0.2104475E-05 2 0.6902392E-04 3 0.1081576E-03 4 0.1469721E-04 5 0.4983571E-06 6 0.9487973E-07 7 0.1449475E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.4903440E-06 1 0.1442057E-03 2 0.1755292E-02 3 0.1597576E-02 4 0.1818472E-03 5 0.3763679E-05 6 0.6986949E-07 7 0.3981335E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.3468129E-12 1 0.1830231E-02 2 0.2430144E-01 3 0.1340601E-01 4 0.1196298E-02 5 0.1900633E-04 6 0.2001412E-06 7 0.1962099E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.7599946E-14 1 0.2196680E-01 2 0.1396693E+00 3 0.4808250E-01 4 0.3259152E-02 5 0.5110871E-04 6 0.2793755E-06 7 0.2958954E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1630696E+00 1 0.4222128E-01 2 0.1447789E+00 3 0.2611038E-01 4 0.2626221E-02 5 0.1001065E-03 6 0.8922922E-06 7 0.8827105E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1658705E-13 1 0.6030206E-02 2 0.6719483E-01 3 0.1421334E+00 4 0.2332277E-01 5 0.4586880E-03 6 0.1449076E-05 7 0.2162172E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.8602086E-12 1 0.3293084E-02 2 0.3018815E-01 3 0.6655830E-01 4 0.1953661E-01 5 0.6261988E-03 6 0.2070777E-05 7 0.1556816E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.1195188E-18 1 0.2088643E-12 2 0.1640600E-11 3 0.5082093E-12 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 0.1929612E-15 1 0.5727832E-13 2 0.3412984E-12 3 0.9332056E-13 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 0.1654908E-17 1 0.3308841E-13 2 0.1924345E-12 3 0.5882812E-12 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 0.2341241E-18 1 0.1768908E-12 2 0.3428509E-12 3 0.1594467E-12 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 0.8374837E-14 1 0.7527780E-13 2 0.2723688E-12 3 0.4209759E-12 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 0.1010476E-18 1 0.8820214E-13 2 0.3271205E-12 3 0.2945643E-12 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 0.2009067E-17 1 0.1109015E-13 2 0.5198497E-12 3 0.2238992E-12 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 0.2031028E-13 1 0.1571177E-12 2 0.3928845E-11 3 0.7857621E-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 -2 0 0.9544899E-19 1 0.2299937E-11 2 0.6075462E-10 3 0.4614225E-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 -1 0 0.1602201E-18 1 0.3546414E-11 2 0.2140537E-09 3 0.8806575E-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 0 0 0.1221179E-09 1 0.1230369E-09 2 0.2120038E-08 3 0.1713795E-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 1 0 0.8196399E-19 1 0.7206140E-09 2 0.5360117E-08 3 0.2648055E-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 0.1628803E-18 1 0.5719117E-08 2 0.1362786E-07 3 0.4806208E-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 0.1758225E-08 1 0.1067025E-07 2 0.7711345E-07 3 0.1333315E-06 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 0.2958937E-17 1 0.1317416E-06 2 0.1380573E-06 3 0.1595554E-06 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 0.1881033E-18 1 0.5239780E-07 2 0.3219507E-06 3 0.2255767E-06 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 0.2524056E-07 1 0.3885854E-06 2 0.3919092E-06 3 0.7474141E-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 7 0 0.3172689E-17 1 0.7418436E-07 2 0.4561857E-06 3 0.1399991E-06 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 0.4650357E-17 1 0.5031532E-06 2 0.7086500E-07 3 0.8770905E-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 9 0 0.1117690E-07 1 0.9766481E-07 2 0.8160265E-07 3 0.4372353E-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 10 0 0.1296156E-17 1 0.3911757E-06 2 0.1980388E-06 3 0.5597417E-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 0 0 0 0.1460604E-08 1 0.8566321E-08 2 0.1019535E-07 3 0.6326611E-08 4 0.5815555E-08 5 0.6265973E-08 6 0.9257061E-08 7 0.6940139E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.4345616E-14 1 0.1770067E-09 2 0.2316203E-10 3 0.9799867E-10 4 0.2406428E-09 5 0.7958546E-09 6 0.1103441E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.9005806E-15 1 0.3972893E-08 2 0.5757952E-09 3 0.1117381E-08 4 0.1750371E-08 5 0.2187141E-08 6 0.1400289E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.8994166E-08 1 0.4471652E-08 2 0.1020246E-07 3 0.5041425E-08 4 0.4005578E-08 5 0.6030938E-08 6 0.1490122E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.7423380E-15 1 0.1227198E-07 2 0.1194064E-06 3 0.6447520E-07 4 0.6110788E-07 5 0.3660621E-07 6 0.1857541E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.6192384E-14 1 0.5849163E-06 2 0.1809697E-06 3 0.2217271E-06 4 0.5123171E-07 5 0.4022487E-07 6 0.1353317E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.2238663E-14 1 0.8520774E-12 2 0.9067920E-12 3 0.5467407E-11 4 0.5982594E-10 5 0.1324965E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.3313569E-12 1 0.2237434E-12 2 0.2737622E-11 3 0.1068983E-10 4 0.4308152E-10 5 0.8622520E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.2253722E-15 1 0.2507858E-10 2 0.6000863E-10 3 0.7208710E-10 4 0.1922058E-09 5 0.3554144E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.2299847E-15 1 0.3459742E-09 2 0.1898853E-08 3 0.3358518E-08 4 0.4911161E-09 5 0.3957592E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.8266832E-08 1 0.1304313E-07 2 0.2065850E-08 3 0.3443358E-08 4 0.7318186E-09 5 0.1368265E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.2953498E-15 1 0.8705981E-08 2 0.2772902E-08 3 0.7281524E-08 4 0.2926983E-08 5 0.1301979E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.6243027E-14 1 0.2804286E-07 2 0.1204479E-06 3 0.1280456E-07 4 0.5267802E-08 5 0.2743583E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.1043896E-07 1 0.1225076E-06 2 0.8040393E-06 3 0.2059644E-06 4 0.3488446E-07 5 0.1021080E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.2250429E-13 1 0.5653817E-05 2 0.6863093E-05 3 0.8155524E-06 4 0.4830473E-07 5 0.3675479E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.9684954E-13 1 0.3036200E-12 2 0.1060425E-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 = 1 6 -5 0 0.7911506E-19 1 0.1407295E-12 2 0.1168608E-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 6 -4 0 0.7413319E-18 1 0.1171171E-13 2 0.3116485E-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 6 -3 0 0.7235402E-14 1 0.2091784E-12 2 0.2223659E-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 = 1 6 -2 0 0.1590095E-18 1 0.3348026E-11 2 0.1338474E-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 -1 0 0.4062645E-19 1 0.2582046E-09 2 0.2349764E-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 0.3076708E-09 1 0.1020599E-08 2 0.3614935E-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 1 0 0.8828904E-19 1 0.1309617E-09 2 0.1205669E-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 0.1066865E-18 1 0.4288779E-08 2 0.3463003E-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 0.2292527E-09 1 0.8125006E-09 2 0.4611306E-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 0.4587509E-18 1 0.1103222E-07 2 0.2435642E-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 5 0 0.6611430E-18 1 0.2198650E-07 2 0.1743789E-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 6 0 0.3052406E-07 1 0.1918491E-07 2 0.6102415E-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 sum of the probabilities = 0.9989070 average vibrational energy (ev) = 0.000008 average rotational energy (ev) = 0.494407 average diffraction energy (ev) = 0.036195 the reaction probability = 0.1092955D-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 0.9979505E+00 0.4601999E-01 0.4934013E+00 1 0.2503290E-03 0.3771143E-01 0.1427640E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.1155451E-04 0 31 2 -2 0.3260095E-05 0 37 2 -1 0.3817500E-05 0 44 2 0 0.4282246E-05 0 50 2 1 0.3145965E-04 0 56 2 2 0.2658391E-04 0 21 4 -4 0.1905354E-05 0 26 4 -3 0.9733153E-06 0 32 4 -2 0.3336085E-05 0 38 4 -1 0.6775326E-05 0 45 4 0 0.2739211E-04 0 51 4 1 0.1935681E-04 0 57 4 2 0.6304694E-04 0 62 4 3 0.1698393E-03 0 67 4 4 0.1003299E-03 0 13 6 -6 0.2384628E-06 0 17 6 -5 0.8197065E-07 0 22 6 -4 0.3212476E-07 0 27 6 -3 0.9193176E-07 0 33 6 -2 0.6946074E-06 0 39 6 -1 0.5275902E-05 0 46 6 0 0.3535989E-04 0 52 6 1 0.2071597E-03 0 58 6 2 0.6443178E-03 0 63 6 3 0.1105272E-02 0 68 6 4 0.1549221E-02 0 72 6 5 0.2204489E-02 0 76 6 6 0.1476446E-02 0 7 8 -8 0.2967994E-09 0 10 8 -7 0.3120458E-09 0 14 8 -6 0.1697872E-09 0 18 8 -5 0.1376732E-09 0 23 8 -4 0.2692136E-09 0 28 8 -3 0.1448270E-08 0 34 8 -2 0.1173774E-07 0 40 8 -1 0.1873403E-06 0 47 8 0 0.2463594E-05 0 53 8 1 0.6479058E-04 0 59 8 2 0.1145760E-02 0 64 8 3 0.1362417E-01 0 69 8 4 0.8561193E-01 0 73 8 5 0.2002013E+00 0 77 8 6 0.2640041E+00 0 80 8 7 0.1767682E+00 0 83 8 8 0.2488089E+00 0 3 10 -10 0.4388638E-11 0 5 10 -9 0.2384980E-11 0 8 10 -8 0.6168352E-11 0 11 10 -7 0.1829562E-11 0 15 10 -6 0.2636922E-11 0 19 10 -5 0.3103926E-11 0 24 10 -4 0.1433122E-10 0 29 10 -3 0.8371797E-10 0 35 10 -2 0.3329914E-09 0 41 10 -1 0.1547872E-08 0 48 10 0 0.6405624E-08 0 54 10 1 0.2824354E-07 0 60 10 2 0.1153838E-06 0 65 10 3 0.2159628E-06 0 70 10 4 0.8558899E-06 0 74 10 5 0.6045685E-06 0 78 10 6 0.8030737E-05 0 81 10 7 0.3078025E-05 0 84 10 8 0.1263551E-05 0 86 10 9 0.9588613E-06 0 88 10 10 0.1036756E-05 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 0.2885730E-06 1 31 2 -2 0.1321170E-07 1 37 2 -1 0.2945819E-07 1 44 2 0 0.2254250E-06 1 50 2 1 0.1373952E-05 1 56 2 2 0.4164430E-05 1 21 4 -4 0.1676555E-09 1 26 4 -3 0.2614439E-09 1 32 4 -2 0.1246847E-08 1 38 4 -1 0.1287760E-07 1 45 4 0 0.6524641E-07 1 51 4 1 0.2236036E-06 1 57 4 2 0.2496240E-05 1 62 4 3 0.4012241E-04 1 67 4 4 0.1972518E-03 1 13 6 -6 0.7370097E-11 1 17 6 -5 0.2634504E-11 1 22 6 -4 0.2369255E-11 1 27 6 -3 0.9187949E-11 1 33 6 -2 0.5315738E-09 1 39 6 -1 0.3841490E-08 1 46 6 0 0.4221620E-08 1 52 6 1 0.1886274E-08 1 58 6 2 0.1980052E-07 1 63 6 3 0.2767724E-07 1 68 6 4 0.1622433E-06 1 72 6 5 0.3358290E-06 1 76 6 6 0.3503963E-05 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 0.3430068E-06 1 0.2568965E-06 2 0.1068343E-05 3 0.2097673E-05 4 0.3016206E-05 5 0.3024898E-05 6 0.1342339E-05 7 0.3710381E-06 8 0.2751953E-07 9 0.6596120E-08 v, j, mj = 0 2 -2 0 0.4832845E-12 1 0.6035498E-06 2 0.3042682E-06 3 0.5202580E-06 4 0.8489511E-06 5 0.6464689E-06 6 0.2673411E-06 7 0.6057736E-07 8 0.7165008E-08 9 0.1514872E-08 v, j, mj = 0 2 -1 0 0.2432089E-13 1 0.1225124E-06 2 0.1724986E-06 3 0.7909048E-06 4 0.1796679E-05 5 0.7072486E-06 6 0.1904802E-06 7 0.2846073E-07 8 0.7322876E-08 9 0.1392407E-08 v, j, mj = 0 2 0 0 0.1972841E-06 1 0.3957143E-06 2 0.8313393E-06 3 0.8205757E-06 4 0.1022812E-05 5 0.5029849E-06 6 0.3843406E-06 7 0.1156648E-06 8 0.7633792E-08 9 0.3896705E-08 v, j, mj = 0 2 1 0 0.1105358E-12 1 0.1269530E-05 2 0.6873014E-05 3 0.1407120E-04 4 0.5701750E-05 5 0.2442717E-05 6 0.7310754E-06 7 0.3216761E-06 8 0.4645637E-07 9 0.2225836E-08 v, j, mj = 0 2 2 0 0.7142141E-12 1 0.2117722E-05 2 0.4139763E-05 3 0.2574224E-05 4 0.3479369E-05 5 0.6826165E-05 6 0.5137002E-05 7 0.1792763E-05 8 0.4989744E-06 9 0.1792842E-07 v, j, mj = 0 4 -4 0 0.2521985E-12 1 0.3099768E-06 2 0.2811419E-06 3 0.4415410E-06 4 0.4751443E-06 5 0.2799422E-06 6 0.9963014E-07 7 0.1651320E-07 8 0.7513081E-09 9 0.7126051E-09 v, j, mj = 0 4 -3 0 0.1066406E-08 1 0.1538849E-06 2 0.1067037E-06 3 0.2834761E-06 4 0.3058664E-06 5 0.8812605E-07 6 0.2792172E-07 7 0.4089682E-08 8 0.1261160E-08 9 0.9190286E-09 v, j, mj = 0 4 -2 0 0.1321179E-13 1 0.7126793E-06 2 0.2141916E-06 3 0.1014059E-05 4 0.1244229E-05 5 0.1293591E-06 6 0.1320032E-07 7 0.6489700E-08 8 0.9848694E-09 9 0.8920136E-09 v, j, mj = 0 4 -1 0 0.9843643E-14 1 0.3817922E-06 2 0.3425024E-06 3 0.4269082E-05 4 0.1686839E-05 5 0.4231247E-07 6 0.3103093E-07 7 0.1835275E-07 8 0.2203977E-08 9 0.1210738E-08 v, j, mj = 0 4 0 0 0.1957498E-05 1 0.3600698E-06 2 0.6375720E-05 3 0.1673691E-04 4 0.1723036E-05 5 0.1820560E-06 6 0.3385007E-07 7 0.1721915E-07 8 0.2617957E-08 9 0.3135927E-08 v, j, mj = 0 4 1 0 0.2907734E-13 1 0.6580087E-06 2 0.8902666E-05 3 0.7904993E-05 4 0.7463098E-06 5 0.7016440E-06 6 0.3062821E-06 7 0.1313779E-06 8 0.3802738E-08 9 0.1721595E-08 v, j, mj = 0 4 2 0 0.6504331E-12 1 0.2300858E-05 2 0.2260948E-04 3 0.2343654E-04 4 0.9634222E-05 5 0.3983310E-05 6 0.8977313E-06 7 0.1545030E-06 8 0.2606845E-07 9 0.4228230E-08 v, j, mj = 0 4 3 0 0.7125156E-07 1 0.1635554E-04 2 0.1156817E-03 3 0.1358043E-04 4 0.7840557E-05 5 0.9875478E-05 6 0.5692358E-05 7 0.7239328E-06 8 0.1000822E-07 9 0.8012495E-08 v, j, mj = 0 4 4 0 0.2437217E-12 1 0.1550389E-04 2 0.4255068E-05 3 0.1166283E-04 4 0.5267670E-05 5 0.2989251E-04 6 0.2585899E-04 7 0.7522994E-05 8 0.3553208E-06 9 0.1062156E-07 v, j, mj = 0 6 -6 0 0.1618982E-07 1 0.1550336E-07 2 0.3174647E-07 3 0.6034801E-07 4 0.6790689E-07 5 0.3886552E-07 6 0.7474017E-08 7 0.2495161E-09 8 0.9209045E-10 9 0.8711038E-10 v, j, mj = 0 6 -5 0 0.2811763E-13 1 0.9810512E-09 2 0.1527163E-07 3 0.2176795E-07 4 0.2808802E-07 5 0.1322102E-07 6 0.2279164E-08 7 0.1695939E-09 8 0.8823808E-10 9 0.1039557E-09 v, j, mj = 0 6 -4 0 0.1834285E-13 1 0.1567685E-08 2 0.7367505E-08 3 0.1021361E-07 4 0.9333406E-08 5 0.2597611E-08 6 0.4438775E-09 7 0.2360566E-09 8 0.2732812E-09 9 0.9170516E-10 v, j, mj = 0 6 -3 0 0.1112312E-09 1 0.1669437E-07 2 0.5224651E-08 3 0.3557668E-07 4 0.2931389E-07 5 0.2748972E-08 6 0.1090940E-08 7 0.7888094E-09 8 0.2906683E-09 9 0.9153971E-10 v, j, mj = 0 6 -2 0 0.5645121E-13 1 0.7367163E-07 2 0.7764882E-07 3 0.3251363E-06 4 0.2029270E-06 5 0.1024113E-07 6 0.1900935E-08 7 0.1563893E-08 8 0.1382188E-08 9 0.1354769E-09 v, j, mj = 0 6 -1 0 0.2439756E-13 1 0.5188945E-07 2 0.4265819E-06 3 0.3356681E-05 4 0.1349984E-05 5 0.7868212E-07 6 0.6502193E-08 7 0.3498120E-08 8 0.1704758E-08 9 0.3780468E-09 v, j, mj = 0 6 0 0 0.4924946E-06 1 0.3963811E-06 2 0.7470133E-05 3 0.2159921E-04 4 0.5160101E-05 5 0.2203712E-06 6 0.6703084E-08 7 0.8088052E-08 8 0.5921954E-08 9 0.4933063E-09 v, j, mj = 0 6 1 0 0.1620124E-12 1 0.4198749E-06 2 0.8848151E-04 3 0.1067960E-03 4 0.1099073E-04 5 0.4253529E-06 6 0.1588986E-07 7 0.2454555E-07 8 0.3132983E-08 9 0.2681377E-08 v, j, mj = 0 6 2 0 0.2472688E-11 1 0.3489959E-04 2 0.3810271E-03 3 0.2082789E-03 4 0.1718118E-04 5 0.2598653E-05 6 0.2973721E-06 7 0.2405544E-07 8 0.7929731E-08 9 0.3011303E-08 v, j, mj = 0 6 3 0 0.7174716E-06 1 0.1933692E-03 2 0.6275691E-03 3 0.1932286E-03 4 0.7205816E-04 5 0.1675498E-04 6 0.1383744E-05 7 0.1761126E-06 8 0.1065996E-07 9 0.3833511E-08 v, j, mj = 0 6 4 0 0.3684047E-12 1 0.5914303E-03 2 0.3839858E-03 3 0.2265310E-03 4 0.2922987E-03 5 0.5040174E-04 6 0.4329069E-05 7 0.2286964E-06 8 0.1131856E-07 9 0.4639118E-08 v, j, mj = 0 6 5 0 0.7461457E-13 1 0.9990667E-03 2 0.8250540E-03 3 0.1076885E-03 4 0.1980879E-03 5 0.6330362E-04 6 0.1059744E-04 7 0.6542794E-06 8 0.2788203E-07 9 0.8859043E-08 v, j, mj = 0 6 6 0 0.4203308E-03 1 0.5367447E-04 2 0.4667278E-04 3 0.3777911E-04 4 0.3334852E-03 5 0.4661868E-03 6 0.1139390E-03 7 0.4301648E-05 8 0.6891183E-07 9 0.6798191E-08 v, j, mj = 0 8 -8 0 0.1241112E-12 1 0.6390388E-11 2 0.5884951E-10 3 0.1087537E-09 4 0.7995120E-10 5 0.1592510E-10 6 0.1939474E-10 7 0.7410582E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1196276E-12 1 0.1004347E-10 2 0.9106298E-10 3 0.1275919E-09 4 0.6069861E-10 5 0.8071688E-11 6 0.8474880E-11 7 0.5982627E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.9660854E-11 1 0.8527117E-11 2 0.5000311E-10 3 0.2456343E-10 4 0.1775503E-10 5 0.4591108E-11 6 0.1364244E-10 7 0.4104411E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1185161E-13 1 0.1204118E-10 2 0.1373352E-10 3 0.2029137E-10 4 0.1660512E-10 5 0.1790666E-10 6 0.2954379E-10 7 0.2753970E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.3030833E-13 1 0.2828835E-10 2 0.4048865E-10 3 0.4232713E-10 4 0.6152750E-10 5 0.2714447E-10 6 0.5160857E-10 7 0.1779857E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.3662655E-11 1 0.1217025E-09 2 0.9853245E-10 3 0.2261304E-09 4 0.2696067E-09 5 0.2254455E-09 6 0.3693183E-09 7 0.1338719E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.6139674E-14 1 0.4052606E-09 2 0.4119749E-08 3 0.2357931E-08 4 0.2652133E-08 5 0.1204680E-08 6 0.6378453E-09 7 0.3601332E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.1445702E-14 1 0.6768169E-07 2 0.3968648E-07 3 0.4100446E-07 4 0.2633192E-07 5 0.3822042E-08 6 0.5995951E-08 7 0.2817725E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.7001614E-07 1 0.2778958E-06 2 0.1183496E-06 3 0.1316207E-05 4 0.6404184E-06 5 0.2301874E-07 6 0.1163201E-07 7 0.6056428E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.1420834E-13 1 0.1380232E-05 2 0.1751104E-04 3 0.3631057E-04 4 0.9157240E-05 5 0.3868275E-06 6 0.2960245E-07 7 0.1507273E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.1199082E-11 1 0.3954971E-06 2 0.4478164E-03 3 0.5943778E-03 4 0.9907190E-04 5 0.4034295E-05 6 0.4184361E-07 7 0.2207092E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.5006208E-06 1 0.7065868E-03 2 0.6565469E-02 3 0.5580227E-02 4 0.7466985E-03 5 0.2447217E-04 6 0.1942055E-06 7 0.1745662E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.2620846E-11 1 0.7169722E-02 2 0.4795698E-01 3 0.2745737E-01 4 0.2932013E-02 5 0.9500304E-04 6 0.8288581E-06 7 0.1637598E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.2340512E-13 1 0.8760942E-02 2 0.1375226E+00 3 0.4915878E-01 4 0.4509434E-02 5 0.2460573E-03 6 0.3463350E-05 7 0.2260318E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1478990E+00 1 0.2798554E-01 2 0.7115937E-01 3 0.6360752E-02 4 0.9752185E-02 5 0.8361331E-03 6 0.1107123E-04 7 0.3010863E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.4058092E-13 1 0.1589132E-01 2 0.2816322E-01 3 0.9104669E-01 4 0.3927466E-01 5 0.2374255E-02 6 0.1796408E-04 7 0.5909800E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.7080601E-11 1 0.3952073E-02 2 0.3586168E-01 3 0.1169263E+00 4 0.8402614E-01 5 0.7956952E-02 6 0.8559386E-04 7 0.1116016E-06 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.1683626E-16 1 0.6828665E-13 2 0.7803603E-12 3 0.2238299E-11 4 0.1301676E-11 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 0.1597718E-13 1 0.7508197E-13 2 0.4560550E-12 3 0.1329408E-11 4 0.5084585E-12 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 0.3899348E-16 1 0.7561604E-13 2 0.5236393E-12 3 0.8191714E-12 4 0.4749886E-11 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 0.1968342E-16 1 0.2235624E-12 2 0.8313848E-12 3 0.2681012E-12 4 0.5064940E-12 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 0.6979771E-13 1 0.1421265E-12 2 0.8474136E-12 3 0.5709731E-12 4 0.1006611E-11 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 0.5822073E-17 1 0.1341888E-12 2 0.1497750E-11 3 0.7614605E-12 4 0.7105202E-12 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 0.3451500E-18 1 0.8730642E-12 2 0.1914027E-11 3 0.2149337E-11 4 0.9394795E-11 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 0.2632066E-12 1 0.7405842E-11 2 0.1394233E-10 3 0.2577712E-10 4 0.3632947E-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 -2 0 0.1295563E-17 1 0.1876548E-11 2 0.4506135E-10 3 0.1307431E-09 4 0.1553104E-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 -1 0 0.9165234E-18 1 0.5455546E-10 2 0.9562097E-10 3 0.2403252E-09 4 0.1157371E-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 0 0 0.1532185E-09 1 0.1051203E-09 2 0.1469781E-08 3 0.1285305E-08 4 0.3392199E-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 0.6673887E-17 1 0.4379566E-09 2 0.2905698E-08 3 0.7207747E-08 4 0.1769214E-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 0.4563874E-16 1 0.7038759E-08 2 0.2318554E-07 3 0.3424128E-07 4 0.5091820E-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 3 0 0.1248444E-08 1 0.6322862E-08 2 0.4529030E-07 3 0.1290307E-06 4 0.3407053E-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 4 0 0.1241604E-15 1 0.1182976E-06 2 0.1954887E-06 3 0.3842676E-06 4 0.1578359E-06 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 0.2082218E-17 1 0.1350382E-06 2 0.3234586E-06 3 0.1005288E-06 4 0.4554277E-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 6 0 0.3214583E-05 1 0.3683687E-05 2 0.8729503E-06 3 0.1793404E-06 4 0.8017625E-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 7 0 0.5277878E-16 1 0.2046620E-05 2 0.4787579E-06 3 0.4862858E-06 4 0.6636105E-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 8 0 0.5808352E-15 1 0.5022859E-07 2 0.6208087E-06 3 0.2628231E-06 4 0.3296907E-06 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 0.2331070E-08 1 0.8633188E-07 2 0.5598506E-06 3 0.2459608E-06 4 0.6438698E-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 10 0 0.8474652E-15 1 0.3195238E-06 2 0.1733323E-06 3 0.3473043E-06 4 0.1965953E-06 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 0.3233252E-07 1 0.2511641E-07 2 0.5527648E-07 3 0.5207969E-07 4 0.9518786E-07 5 0.8985948E-08 6 0.7526666E-08 7 0.1206743E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.1867248E-14 1 0.2866187E-08 2 0.4506054E-08 3 0.2749749E-08 4 0.1586959E-08 5 0.3244450E-09 6 0.1056409E-08 7 0.1218954E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.2024064E-13 1 0.7607935E-08 2 0.3295033E-08 3 0.1146300E-07 4 0.1599988E-08 5 0.2800918E-08 6 0.2466032E-08 7 0.2252574E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.2526679E-07 1 0.1543121E-07 2 0.4129419E-07 3 0.9768175E-07 4 0.3079781E-07 5 0.8209171E-08 6 0.6033431E-08 7 0.7106848E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.1294160E-13 1 0.2299850E-07 2 0.2158712E-06 3 0.9506494E-06 4 0.1532724E-06 5 0.1703220E-07 6 0.1354721E-07 7 0.5815021E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.5046528E-14 1 0.1155777E-05 2 0.2186427E-05 3 0.2283899E-06 4 0.5481188E-06 5 0.3546597E-07 6 0.8764156E-08 7 0.1487498E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.3661896E-14 1 0.2708206E-11 2 0.1370893E-10 3 0.1520933E-10 4 0.2853010E-10 5 0.1050905E-09 6 0.2404815E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.6377198E-12 1 0.1116139E-11 2 0.1663678E-10 3 0.2847829E-10 4 0.7941540E-10 5 0.1329616E-09 6 0.2198013E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.4821021E-14 1 0.4071484E-10 2 0.1930832E-09 3 0.8706009E-10 4 0.4567040E-09 5 0.4670363E-09 6 0.2243832E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.6567342E-14 1 0.3558407E-08 2 0.2204699E-08 3 0.4406911E-08 4 0.2182951E-08 5 0.5151307E-09 6 0.9499865E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.5839319E-08 1 0.1799887E-07 2 0.2475310E-07 3 0.1053426E-07 4 0.4950600E-08 5 0.1121616E-08 6 0.4864376E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.1195633E-13 1 0.5868728E-08 2 0.8679919E-07 3 0.1048790E-06 4 0.2064810E-07 5 0.5248317E-08 6 0.1602481E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.2018001E-12 1 0.2619162E-06 2 0.1125695E-05 3 0.1045563E-05 4 0.4986094E-07 5 0.1315059E-07 6 0.5392193E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.2115444E-07 1 0.5708111E-05 2 0.2364873E-04 3 0.1009793E-04 4 0.6113452E-06 5 0.3498633E-07 6 0.1542290E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.5823110E-13 1 0.5175711E-05 2 0.1316164E-03 3 0.5746424E-04 4 0.2935146E-05 5 0.6020679E-07 6 0.1074546E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.2750778E-12 1 0.1942931E-11 2 0.4370209E-11 3 0.7818789E-12 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 0.3453104E-18 1 0.1192294E-12 2 0.6861098E-12 3 0.1829164E-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 6 -4 0 0.6274332E-17 1 0.1697018E-12 2 0.1190570E-11 3 0.1008976E-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 6 -3 0 0.1125144E-12 1 0.7624591E-12 2 0.2369888E-11 3 0.5943088E-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 6 -2 0 0.8213097E-17 1 0.1693773E-10 2 0.2738793E-09 3 0.2407567E-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 -1 0 0.1146309E-16 1 0.6185974E-09 2 0.2404615E-08 3 0.8182773E-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 0 0 0.5307538E-09 1 0.2700480E-08 2 0.5513611E-09 3 0.4390251E-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 1 0 0.1118581E-16 1 0.7260759E-09 2 0.5897366E-09 3 0.5704611E-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 2 0 0.2719810E-15 1 0.7079537E-08 2 0.9481823E-08 3 0.3239165E-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 3 0 0.2659741E-08 1 0.1245265E-07 2 0.8296541E-08 3 0.4268308E-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 0.3897584E-16 1 0.7517615E-07 2 0.7505939E-07 3 0.1200772E-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 5 0 0.5863592E-17 1 0.2518767E-06 2 0.6321302E-07 3 0.2073926E-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 6 0 0.8535437E-06 1 0.2193799E-05 2 0.4391191E-06 3 0.1750166E-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 sum of the probabilities = 0.9982009 average vibrational energy (ev) = 0.000128 average rotational energy (ev) = 0.493313 average diffraction energy (ev) = 0.046018 the reaction probability = 0.1799133D-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 0.9877020E+00 0.5287762E-01 0.4906938E+00 1 0.7360261E-02 0.1422921E-01 0.2766436E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.5703487E-04 0 31 2 -2 0.2349650E-04 0 37 2 -1 0.2392420E-04 0 44 2 0 0.3640135E-04 0 50 2 1 0.1564932E-03 0 56 2 2 0.1283099E-03 0 21 4 -4 0.8705324E-05 0 26 4 -3 0.7880407E-05 0 32 4 -2 0.2454140E-04 0 38 4 -1 0.2917167E-04 0 45 4 0 0.8255337E-04 0 51 4 1 0.4166997E-04 0 57 4 2 0.2952182E-03 0 62 4 3 0.5543547E-03 0 67 4 4 0.5066257E-03 0 13 6 -6 0.1583225E-05 0 17 6 -5 0.4567123E-06 0 22 6 -4 0.7242805E-06 0 27 6 -3 0.1488285E-05 0 33 6 -2 0.6599473E-05 0 39 6 -1 0.3876179E-04 0 46 6 0 0.1977408E-03 0 52 6 1 0.8133318E-03 0 58 6 2 0.1675524E-02 0 63 6 3 0.1486364E-02 0 68 6 4 0.4226352E-02 0 72 6 5 0.4694643E-02 0 76 6 6 0.4675542E-02 0 7 8 -8 0.1594632E-07 0 10 8 -7 0.1461811E-07 0 14 8 -6 0.4136207E-08 0 18 8 -5 0.2043131E-08 0 23 8 -4 0.2216590E-08 0 28 8 -3 0.7572203E-08 0 34 8 -2 0.8709832E-07 0 40 8 -1 0.1348175E-05 0 47 8 0 0.2381651E-04 0 53 8 1 0.4378120E-03 0 59 8 2 0.5180981E-02 0 64 8 3 0.3673514E-01 0 69 8 4 0.1231879E+00 0 73 8 5 0.1242010E+00 0 77 8 6 0.2399945E+00 0 80 8 7 0.1267080E+00 0 83 8 8 0.3113113E+00 0 3 10 -10 0.1210357E-10 0 5 10 -9 0.5930575E-11 0 8 10 -8 0.5224491E-11 0 11 10 -7 0.9842532E-11 0 15 10 -6 0.1133001E-10 0 19 10 -5 0.3587085E-10 0 24 10 -4 0.8229618E-10 0 29 10 -3 0.5500545E-09 0 35 10 -2 0.2662163E-08 0 41 10 -1 0.7128256E-08 0 48 10 0 0.2083178E-07 0 54 10 1 0.5687997E-07 0 60 10 2 0.3394584E-06 0 65 10 3 0.1160960E-05 0 70 10 4 0.5738666E-06 0 74 10 5 0.1477691E-04 0 78 10 6 0.8155309E-04 0 81 10 7 0.2089773E-04 0 84 10 8 0.2790614E-05 0 86 10 9 0.7896059E-06 0 88 10 10 0.1625651E-05 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 0.7494033E-05 1 31 2 -2 0.4513310E-05 1 37 2 -1 0.2423912E-06 1 44 2 0 0.7659889E-05 1 50 2 1 0.9650596E-05 1 56 2 2 0.3821032E-04 1 21 4 -4 0.8925077E-07 1 26 4 -3 0.7106437E-07 1 32 4 -2 0.1266973E-06 1 38 4 -1 0.9228414E-07 1 45 4 0 0.7837281E-06 1 51 4 1 0.5871561E-05 1 57 4 2 0.4562912E-04 1 62 4 3 0.2957657E-03 1 67 4 4 0.4248845E-03 1 13 6 -6 0.7528223E-10 1 17 6 -5 0.3724799E-10 1 22 6 -4 0.2597447E-10 1 27 6 -3 0.2068858E-09 1 33 6 -2 0.1288208E-08 1 39 6 -1 0.2936613E-08 1 46 6 0 0.7535941E-08 1 52 6 1 0.8930516E-08 1 58 6 2 0.4716293E-07 1 63 6 3 0.5730782E-06 1 68 6 4 0.1549845E-04 1 72 6 5 0.2959789E-03 1 76 6 6 0.6207058E-02 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 0.3563916E-06 1 0.8187552E-06 2 0.1360114E-05 3 0.7547755E-05 4 0.8867823E-05 5 0.1554218E-04 6 0.1496264E-04 7 0.6404025E-05 8 0.1114480E-05 9 0.6069571E-07 v, j, mj = 0 2 -2 0 0.1126501E-10 1 0.4977940E-05 2 0.2477451E-05 3 0.1303488E-05 4 0.2725071E-05 5 0.6274556E-05 6 0.4211508E-05 7 0.1346606E-05 8 0.1700225E-06 9 0.9845167E-08 v, j, mj = 0 2 -1 0 0.1562956E-11 1 0.4354091E-06 2 0.3129910E-05 3 0.5805060E-05 4 0.7865274E-05 5 0.4562561E-05 6 0.1625789E-05 7 0.4479845E-06 8 0.4985709E-07 9 0.2352416E-08 v, j, mj = 0 2 0 0 0.1878142E-05 1 0.8340601E-06 2 0.8290155E-05 3 0.4572636E-05 4 0.6055912E-05 5 0.7619328E-05 6 0.4687892E-05 7 0.2013352E-05 8 0.4278013E-06 9 0.2207023E-07 v, j, mj = 0 2 1 0 0.2003728E-11 1 0.2532161E-05 2 0.2362200E-04 3 0.5377778E-04 4 0.4648549E-04 5 0.1733013E-04 6 0.8094018E-05 7 0.4004557E-05 8 0.6250467E-06 9 0.2199025E-07 v, j, mj = 0 2 2 0 0.4163208E-11 1 0.3353514E-05 2 0.2739749E-05 3 0.8956991E-05 4 0.7066241E-05 5 0.3028655E-04 6 0.4388629E-04 7 0.2476169E-04 8 0.6846973E-05 9 0.4119018E-06 v, j, mj = 0 4 -4 0 0.1219059E-10 1 0.1977783E-05 2 0.1084516E-05 3 0.8409952E-06 4 0.1882385E-05 5 0.1710678E-05 6 0.9724297E-06 7 0.2216372E-06 8 0.1397049E-07 9 0.9170514E-09 v, j, mj = 0 4 -3 0 0.5061695E-08 1 0.6895822E-06 2 0.1003225E-05 3 0.3058880E-05 4 0.1715438E-05 5 0.1179537E-05 6 0.1988616E-06 7 0.2689290E-07 8 0.1897078E-08 9 0.1031920E-08 v, j, mj = 0 4 -2 0 0.8344605E-12 1 0.2835205E-05 2 0.3767844E-05 3 0.7078531E-05 4 0.8403526E-05 5 0.2062744E-05 6 0.3319058E-06 7 0.5454714E-07 8 0.6283199E-08 9 0.8130575E-09 v, j, mj = 0 4 -1 0 0.7893180E-12 1 0.1141875E-05 2 0.2192496E-05 3 0.1472816E-04 4 0.1016353E-04 5 0.7686901E-06 6 0.1054265E-06 7 0.6174352E-07 8 0.8792906E-08 9 0.9579373E-09 v, j, mj = 0 4 0 0 0.4964027E-05 1 0.2239082E-05 2 0.1554262E-04 3 0.4479541E-04 4 0.1286722E-04 5 0.1414758E-05 6 0.5586126E-06 7 0.1464963E-06 8 0.2216496E-07 9 0.2980033E-08 v, j, mj = 0 4 1 0 0.2363277E-11 1 0.8128605E-06 2 0.1218575E-04 3 0.1615330E-04 4 0.4668604E-05 5 0.4188856E-05 6 0.2774715E-05 7 0.8082623E-06 8 0.7576316E-07 9 0.1861243E-08 v, j, mj = 0 4 2 0 0.4124729E-12 1 0.7060124E-06 2 0.8424290E-04 3 0.1012358E-03 4 0.5442607E-04 5 0.3523213E-04 6 0.1535186E-04 7 0.3647376E-05 8 0.3684898E-06 9 0.7527535E-08 v, j, mj = 0 4 3 0 0.1185269E-06 1 0.2768510E-04 2 0.2200662E-03 3 0.1505811E-03 4 0.6732579E-04 5 0.3019307E-04 6 0.4431228E-04 7 0.1337945E-04 8 0.6854953E-06 9 0.7693990E-08 v, j, mj = 0 4 4 0 0.2017710E-11 1 0.1501063E-04 2 0.4226013E-04 3 0.4342695E-04 4 0.1681719E-04 5 0.1213024E-03 6 0.1779286E-03 7 0.8208719E-04 8 0.7728790E-05 9 0.6374021E-07 v, j, mj = 0 6 -6 0 0.2086299E-06 1 0.1670242E-06 2 0.1689608E-06 3 0.2093580E-06 4 0.3975422E-06 5 0.3243001E-06 6 0.9941844E-07 7 0.7671955E-08 8 0.1704162E-09 9 0.1491511E-09 v, j, mj = 0 6 -5 0 0.1837248E-12 1 0.3495897E-08 2 0.1397492E-06 3 0.1160226E-06 4 0.1065369E-06 5 0.7331701E-07 6 0.1649030E-07 7 0.7772053E-09 8 0.1891209E-09 9 0.1338109E-09 v, j, mj = 0 6 -4 0 0.6495293E-12 1 0.1012374E-06 2 0.2852769E-06 3 0.1671171E-06 4 0.1425984E-06 5 0.2246049E-07 6 0.3936664E-08 7 0.9333074E-09 8 0.5434640E-09 9 0.1762169E-09 v, j, mj = 0 6 -3 0 0.3142179E-08 1 0.1344233E-06 2 0.2158601E-06 3 0.5453278E-06 4 0.5576514E-06 5 0.2712622E-07 6 0.2885403E-08 7 0.8418065E-09 8 0.7767331E-09 9 0.2501268E-09 v, j, mj = 0 6 -2 0 0.1081415E-12 1 0.7370116E-06 2 0.3397015E-06 3 0.3187435E-05 4 0.2295045E-05 5 0.3199705E-07 6 0.3649417E-08 7 0.2628420E-08 8 0.1583700E-08 9 0.4213497E-09 v, j, mj = 0 6 -1 0 0.2687979E-12 1 0.5524043E-06 2 0.3976479E-05 3 0.2561039E-04 4 0.8551468E-05 5 0.5440930E-07 6 0.6970897E-08 7 0.4932447E-08 8 0.4249596E-08 9 0.4916933E-09 v, j, mj = 0 6 0 0 0.4483105E-05 1 0.2087831E-05 2 0.4799453E-04 3 0.1281598E-03 4 0.1482307E-04 5 0.1554914E-06 6 0.1593163E-07 7 0.1625289E-07 8 0.3499339E-08 9 0.1264089E-08 v, j, mj = 0 6 1 0 0.9271935E-12 1 0.4708940E-05 2 0.4265722E-03 3 0.3706567E-03 4 0.9915309E-05 5 0.1243195E-05 6 0.1948053E-06 7 0.2960798E-07 8 0.7895277E-08 9 0.3034162E-08 v, j, mj = 0 6 2 0 0.1198644E-10 1 0.1367050E-03 2 0.1178262E-02 3 0.3073084E-03 4 0.3879951E-04 5 0.1205547E-04 6 0.2153886E-05 7 0.2239714E-06 8 0.1205213E-07 9 0.3752722E-08 v, j, mj = 0 6 3 0 0.1209524E-05 1 0.3640324E-03 2 0.5302218E-03 3 0.2729981E-03 4 0.2152273E-03 5 0.8680399E-04 6 0.1459439E-04 7 0.1243918E-05 8 0.2696486E-07 9 0.5599474E-08 v, j, mj = 0 6 4 0 0.5585808E-11 1 0.1155051E-02 2 0.1654382E-02 3 0.5158891E-03 4 0.5880386E-03 5 0.2640446E-03 6 0.4559949E-04 7 0.3268183E-05 8 0.6290129E-07 9 0.1613127E-07 v, j, mj = 0 6 5 0 0.4238159E-12 1 0.2393071E-02 2 0.1071226E-02 3 0.6323778E-03 4 0.1745214E-03 5 0.2952046E-03 6 0.1166188E-03 7 0.1135898E-04 8 0.2442969E-06 9 0.1953724E-07 v, j, mj = 0 6 6 0 0.1041081E-03 1 0.7229637E-03 2 0.4205496E-03 3 0.2891491E-03 4 0.7058116E-03 5 0.1648208E-02 6 0.7230585E-03 7 0.6084195E-04 8 0.8341575E-06 9 0.1791717E-07 v, j, mj = 0 8 -8 0 0.3283842E-12 1 0.1049371E-08 2 0.5121854E-09 3 0.4187686E-08 4 0.7966839E-08 5 0.2118997E-08 6 0.7464579E-10 7 0.1972247E-10 8 0.1654416E-10 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.6046503E-13 1 0.2333012E-10 2 0.1253393E-08 3 0.5695799E-08 4 0.6390024E-08 5 0.1169709E-08 6 0.3875196E-10 7 0.2884540E-10 8 0.1819208E-10 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.1848109E-10 1 0.2864412E-09 2 0.1066982E-08 3 0.1584174E-08 4 0.9034181E-09 5 0.1959930E-09 6 0.2825244E-10 7 0.2878225E-10 8 0.2368273E-10 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1962700E-12 1 0.2553974E-09 2 0.8629378E-09 3 0.6210764E-09 4 0.1529401E-09 5 0.4152778E-10 6 0.4618046E-10 7 0.4691828E-10 8 0.1595662E-10 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1349245E-12 1 0.9846646E-09 2 0.1624740E-09 3 0.4117410E-09 4 0.4111714E-09 5 0.8187238E-10 6 0.6130564E-10 7 0.7146358E-10 8 0.3176240E-10 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.1269724E-10 1 0.8087303E-09 2 0.1305499E-08 3 0.2210734E-08 4 0.1776307E-08 5 0.6819497E-09 6 0.4255531E-09 7 0.3124268E-09 8 0.3830624E-10 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.4102046E-13 1 0.1043291E-08 2 0.3935924E-07 3 0.2229439E-07 4 0.1923994E-07 5 0.3718370E-08 6 0.8483564E-09 7 0.5247916E-09 8 0.6989827E-10 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.8287994E-14 1 0.2471125E-06 2 0.2415096E-06 3 0.5313445E-06 4 0.3084914E-06 5 0.1069797E-07 6 0.5157586E-08 7 0.3277481E-08 8 0.5841813E-09 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.2654587E-06 1 0.8220986E-06 2 0.2244985E-05 3 0.1555209E-04 4 0.4754409E-05 5 0.1616978E-06 6 0.8436790E-08 7 0.6412286E-08 8 0.9204982E-09 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.1363224E-12 1 0.6964222E-05 2 0.1293264E-03 3 0.2500803E-03 4 0.4924224E-04 5 0.2150529E-05 6 0.3098280E-07 7 0.1577958E-07 8 0.1522596E-08 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.1074741E-10 1 0.1737227E-04 2 0.2464444E-02 3 0.2335844E-02 4 0.3476917E-03 5 0.1538478E-04 6 0.2229820E-06 7 0.1913304E-07 8 0.2180191E-08 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.2223205E-05 1 0.2860307E-02 2 0.1976167E-01 3 0.1257541E-01 4 0.1465149E-02 5 0.6906607E-04 6 0.1263731E-05 7 0.4225522E-07 8 0.2525531E-08 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.1417669E-10 1 0.1757148E-01 2 0.6989967E-01 3 0.3226852E-01 4 0.3196239E-02 5 0.2449327E-03 6 0.6973595E-05 7 0.7425445E-07 8 0.3364229E-08 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1250110E-12 1 0.8563621E-03 2 0.9663885E-01 3 0.2035819E-01 4 0.5315891E-02 5 0.1002704E-02 6 0.2886020E-04 7 0.1186213E-06 8 0.3163999E-08 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1247012E+00 1 0.2699984E-01 2 0.3205401E-01 3 0.2460762E-01 4 0.2815630E-01 5 0.3389469E-02 6 0.8584854E-04 7 0.2640010E-06 8 0.6940921E-08 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1546523E-12 1 0.2112190E-01 2 0.3264278E-01 3 0.5507054E-01 4 0.1323304E-01 5 0.4493543E-02 6 0.1457339E-03 7 0.5146785E-06 8 0.4995436E-08 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.3791650E-10 1 0.1237294E-01 2 0.4481032E-01 3 0.9465289E-01 4 0.1263694E+00 5 0.3208957E-01 6 0.1013308E-02 7 0.2799984E-05 8 0.1787739E-07 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.4999363E-15 1 0.4614660E-12 2 0.9151147E-13 3 0.1686620E-11 4 0.5530002E-11 5 0.4333467E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.3763606E-13 1 0.1095058E-12 2 0.3880431E-12 3 0.1334712E-11 4 0.1935756E-11 5 0.2124923E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.1308372E-14 1 0.2459554E-12 2 0.1079334E-11 3 0.1847870E-11 4 0.1066579E-11 5 0.9834445E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.1314753E-14 1 0.1947730E-11 2 0.1272688E-11 3 0.8617654E-12 4 0.9753154E-12 5 0.4783719E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.1844121E-12 1 0.1902694E-11 2 0.2178914E-11 3 0.2448757E-11 4 0.1994065E-11 5 0.2621166E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.2520153E-15 1 0.7768259E-12 2 0.1692084E-10 3 0.6037066E-11 4 0.6899693E-11 5 0.5236171E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.1421263E-15 1 0.8744157E-11 2 0.2354602E-10 3 0.1253154E-10 4 0.2630765E-10 5 0.1116666E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.2753866E-12 1 0.1240609E-09 2 0.8951359E-10 3 0.1051791E-09 4 0.1450404E-09 5 0.8598506E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.8613337E-17 1 0.5312928E-10 2 0.7370458E-09 3 0.1015888E-08 4 0.5461903E-09 5 0.3099101E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.4852735E-17 1 0.9813619E-09 2 0.1371131E-08 3 0.2186012E-08 4 0.1403599E-08 5 0.1186152E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.3691389E-09 1 0.1245597E-08 2 0.2390399E-08 3 0.6420130E-08 4 0.5894553E-08 5 0.4511964E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.5496325E-16 1 0.2341432E-08 2 0.1111187E-07 3 0.2399695E-07 4 0.1411387E-07 5 0.5315851E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.1172051E-14 1 0.1978754E-07 2 0.1586855E-06 3 0.7159095E-07 4 0.4295854E-07 5 0.4643593E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.3561290E-08 1 0.8769315E-07 2 0.8293786E-06 3 0.1267219E-06 4 0.8288612E-07 5 0.3071892E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.2864898E-14 1 0.5754573E-07 2 0.2648903E-06 3 0.1361403E-06 4 0.5987905E-07 5 0.5541119E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.8614144E-16 1 0.1133093E-04 2 0.3104744E-05 3 0.2527606E-06 4 0.5754324E-07 5 0.3093458E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.1482569E-04 1 0.5529008E-04 2 0.1107048E-04 3 0.2479623E-06 4 0.7129784E-07 5 0.4757536E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.6824077E-15 1 0.1271891E-04 2 0.7723962E-05 3 0.2842349E-06 4 0.1433768E-06 5 0.2724457E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.2769750E-13 1 0.8857498E-06 2 0.3453911E-06 3 0.1186499E-05 4 0.2726457E-06 5 0.1003284E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.1036463E-07 1 0.1512707E-06 2 0.1709364E-06 3 0.2233620E-06 4 0.1557836E-06 5 0.7788855E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.3112319E-12 1 0.8405520E-07 2 0.4017880E-06 3 0.4779135E-06 4 0.5525433E-06 5 0.1093508E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.8614289E-06 1 0.4310397E-06 2 0.3320787E-06 3 0.1104603E-05 4 0.3761087E-05 5 0.9715352E-06 6 0.2899576E-07 7 0.2931961E-08 8 0.3332255E-09 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.7644391E-12 1 0.5269971E-06 2 0.4093108E-06 3 0.3746378E-06 4 0.2642948E-05 5 0.5439887E-06 6 0.1367301E-07 7 0.1753631E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.3351043E-12 1 0.4941499E-07 2 0.2103714E-07 3 0.9715371E-07 4 0.5598355E-07 5 0.1565415E-07 6 0.1833394E-08 7 0.1313955E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.3577721E-06 1 0.5505805E-06 2 0.1711315E-05 3 0.1728676E-05 4 0.2705413E-05 5 0.5800018E-06 6 0.2401657E-07 7 0.2113306E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.1394153E-12 1 0.7682830E-06 2 0.3118403E-05 3 0.4488056E-05 4 0.1149550E-05 5 0.1110084E-06 6 0.1208136E-07 7 0.3215204E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.4883908E-12 1 0.3891409E-05 2 0.6260639E-05 3 0.1206419E-04 4 0.1383737E-04 5 0.2115248E-05 6 0.3708376E-07 7 0.4388034E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.2308291E-13 1 0.2165109E-08 2 0.9345149E-08 3 0.6156226E-07 4 0.1586687E-07 5 0.2254721E-09 6 0.8587796E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.1204924E-10 1 0.3006263E-10 2 0.8747603E-08 3 0.5319178E-07 4 0.8886927E-08 5 0.9584360E-10 6 0.1001001E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.4333804E-13 1 0.1208955E-07 2 0.3900127E-07 3 0.2527207E-08 4 0.6581079E-07 5 0.7155158E-08 6 0.1132488E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.1071429E-13 1 0.1703243E-07 2 0.3908849E-07 3 0.2807989E-07 4 0.6157464E-08 5 0.1656105E-08 6 0.2697489E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.1968822E-07 1 0.5062404E-07 2 0.2073022E-06 3 0.3930222E-06 4 0.1021476E-06 5 0.1026210E-07 6 0.6817532E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.1545693E-12 1 0.3412692E-06 2 0.2857858E-05 3 0.2453573E-05 4 0.2098186E-06 5 0.7819528E-08 6 0.1223211E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.1327095E-11 1 0.1423148E-05 2 0.2946896E-04 3 0.1395044E-04 4 0.7484595E-06 5 0.3405635E-07 6 0.4046480E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.2337095E-06 1 0.6144626E-04 2 0.1440919E-03 3 0.7579496E-04 4 0.1383669E-04 5 0.3515421E-06 6 0.1061771E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.6054517E-12 1 0.7329367E-04 2 0.8194335E-05 3 0.2766168E-03 4 0.6525523E-04 5 0.1515299E-05 6 0.9103650E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.5584344E-11 1 0.4817334E-10 2 0.1256785E-10 3 0.4910305E-11 4 0.4046396E-11 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 0.4366189E-15 1 0.1660399E-11 2 0.7185120E-11 3 0.1571653E-10 4 0.1268550E-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 6 -4 0 0.2278441E-16 1 0.1055044E-11 2 0.6735526E-11 3 0.1517226E-10 4 0.3011625E-11 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 0.1453089E-11 1 0.4613268E-11 2 0.5141211E-10 3 0.1178915E-09 4 0.3151586E-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 6 -2 0 0.8223438E-16 1 0.7848093E-11 2 0.2575203E-09 3 0.7528519E-09 4 0.2699879E-09 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 0.2397388E-15 1 0.2651122E-09 2 0.1590506E-08 3 0.8104727E-09 4 0.2705210E-09 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 0.1951228E-08 1 0.2853307E-08 2 0.7848979E-09 3 0.8822912E-09 4 0.1064217E-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 1 0 0.5668822E-15 1 0.9997170E-09 2 0.4835950E-08 3 0.1731591E-08 4 0.1363257E-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 0.6187713E-14 1 0.3869737E-08 2 0.2755792E-07 3 0.8131868E-08 4 0.7603403E-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 0.3344361E-08 1 0.1436915E-06 2 0.3819345E-06 3 0.3641331E-07 4 0.7694569E-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 0.3526316E-14 1 0.5030349E-05 2 0.9287630E-05 3 0.1158749E-05 4 0.2171983E-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 5 0 0.6701429E-15 1 0.1626360E-03 2 0.1247079E-03 3 0.8608869E-05 4 0.2614650E-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 6 0 0.1535578E-02 1 0.3773189E-02 2 0.8720124E-03 3 0.2617051E-04 4 0.1074224E-06 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9950623 average vibrational energy (ev) = 0.003768 average rotational energy (ev) = 0.489111 average diffraction energy (ev) = 0.052592 the reaction probability = 0.4937710D-02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.38986810D+01 trans energy = 0.49285714D+00 trans energy in z = 0.49285714D+00 total momentum = 0.11536724D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9399317E+00 0.5605530E-01 0.4848915E+00 1 0.2242254E-01 0.2223389E-01 0.2724175E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.2149572E-03 0 31 2 -2 0.1279385E-03 0 37 2 -1 0.1519807E-03 0 44 2 0 0.1901278E-03 0 50 2 1 0.4744541E-03 0 56 2 2 0.6185180E-03 0 21 4 -4 0.8442269E-04 0 26 4 -3 0.7303372E-04 0 32 4 -2 0.1148830E-03 0 38 4 -1 0.1293928E-03 0 45 4 0 0.1997016E-03 0 51 4 1 0.2273275E-03 0 57 4 2 0.9776172E-03 0 62 4 3 0.1258295E-02 0 67 4 4 0.1863605E-02 0 13 6 -6 0.2334708E-04 0 17 6 -5 0.1180168E-04 0 22 6 -4 0.1407982E-04 0 27 6 -3 0.1290645E-04 0 33 6 -2 0.4744845E-04 0 39 6 -1 0.2054471E-03 0 46 6 0 0.7716662E-03 0 52 6 1 0.2103311E-02 0 58 6 2 0.2705039E-02 0 63 6 3 0.2627465E-02 0 68 6 4 0.9470302E-02 0 72 6 5 0.7323282E-02 0 76 6 6 0.1007419E-01 0 7 8 -8 0.4104365E-06 0 10 8 -7 0.9861194E-07 0 14 8 -6 0.2339852E-06 0 18 8 -5 0.1167821E-06 0 23 8 -4 0.6368558E-07 0 28 8 -3 0.1180195E-06 0 34 8 -2 0.1121122E-05 0 40 8 -1 0.1289842E-04 0 47 8 0 0.1870177E-03 0 53 8 1 0.2179185E-02 0 59 8 2 0.1627740E-01 0 64 8 3 0.6617199E-01 0 69 8 4 0.1029027E+00 0 73 8 5 0.7166344E-01 0 77 8 6 0.2510674E+00 0 80 8 7 0.1634200E+00 0 83 8 8 0.2235157E+00 0 3 10 -10 0.2996823E-10 0 5 10 -9 0.3531372E-10 0 8 10 -8 0.5626556E-10 0 11 10 -7 0.4789143E-10 0 15 10 -6 0.8058279E-10 0 19 10 -5 0.2262890E-09 0 24 10 -4 0.5692762E-09 0 29 10 -3 0.2710236E-08 0 35 10 -2 0.7928922E-08 0 41 10 -1 0.1267610E-07 0 48 10 0 0.7782796E-07 0 54 10 1 0.5898161E-06 0 60 10 2 0.2418456E-05 0 65 10 3 0.5043870E-05 0 70 10 4 0.1132728E-04 0 74 10 5 0.1579972E-03 0 78 10 6 0.1453283E-03 0 81 10 7 0.9438420E-04 0 84 10 8 0.1209391E-04 0 86 10 9 0.2523976E-05 0 88 10 10 0.3448849E-05 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 0.7906060E-04 1 31 2 -2 0.5606703E-04 1 37 2 -1 0.1534756E-04 1 44 2 0 0.3903834E-04 1 50 2 1 0.9742225E-04 1 56 2 2 0.3378365E-03 1 21 4 -4 0.1506699E-04 1 26 4 -3 0.5502044E-05 1 32 4 -2 0.3078151E-05 1 38 4 -1 0.2388056E-05 1 45 4 0 0.7212355E-05 1 51 4 1 0.6761451E-04 1 57 4 2 0.3628190E-03 1 62 4 3 0.9711493E-03 1 67 4 4 0.8358165E-03 1 13 6 -6 0.5915474E-07 1 17 6 -5 0.2909179E-07 1 22 6 -4 0.1474542E-07 1 27 6 -3 0.9876811E-08 1 33 6 -2 0.6675906E-08 1 39 6 -1 0.8658219E-08 1 46 6 0 0.3774248E-07 1 52 6 1 0.2517854E-06 1 58 6 2 0.1521605E-05 1 63 6 3 0.3891168E-04 1 68 6 4 0.5419870E-03 1 72 6 5 0.2984663E-02 1 76 6 6 0.1595961E-01 1 7 8 -8 0.3223455E-13 1 10 8 -7 0.2408177E-12 1 14 8 -6 0.6006249E-12 1 18 8 -5 0.6371941E-13 1 23 8 -4 0.1488484E-13 1 28 8 -3 0.1867750E-12 1 34 8 -2 0.4386643E-13 1 40 8 -1 0.1120854E-12 1 47 8 0 0.6792253E-11 1 53 8 1 0.8621196E-12 1 59 8 2 0.1060214E-10 1 64 8 3 0.1268144E-09 1 69 8 4 0.1633531E-10 1 73 8 5 0.1772722E-09 1 77 8 6 0.1127162E-08 1 80 8 7 0.4029525E-09 1 83 8 8 0.1383378E-10 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 0.5107014E-07 1 0.6597773E-06 2 0.2237177E-05 3 0.7778864E-05 4 0.2104844E-04 5 0.2606606E-04 6 0.8087131E-04 7 0.5845095E-04 8 0.1632595E-04 9 0.1467576E-05 v, j, mj = 0 2 -2 0 0.1485037E-10 1 0.1096327E-04 2 0.1426065E-04 3 0.1241558E-04 4 0.5262477E-05 5 0.2159798E-04 6 0.3760130E-04 7 0.2049527E-04 8 0.5004557E-05 9 0.3373619E-06 v, j, mj = 0 2 -1 0 0.7521931E-11 1 0.6012074E-05 2 0.2405217E-04 3 0.3527207E-04 4 0.3753498E-04 5 0.2607359E-04 6 0.1629478E-04 7 0.5700574E-05 8 0.9943118E-06 9 0.4613248E-07 v, j, mj = 0 2 0 0 0.6668247E-05 1 0.4209750E-05 2 0.2647786E-04 3 0.2394517E-04 4 0.2526981E-04 5 0.3942329E-04 6 0.3679779E-04 7 0.2039000E-04 8 0.6392418E-05 9 0.5534717E-06 v, j, mj = 0 2 1 0 0.1024292E-10 1 0.7006579E-05 2 0.3396203E-04 3 0.9398680E-04 4 0.1474914E-03 5 0.7483689E-04 6 0.7037321E-04 7 0.3681717E-04 8 0.9516366E-05 9 0.4636622E-06 v, j, mj = 0 2 2 0 0.4546989E-11 1 0.1097191E-04 2 0.2020910E-04 3 0.3743487E-04 4 0.1059016E-04 5 0.6288054E-04 6 0.2053331E-03 7 0.1913654E-03 8 0.7229658E-04 9 0.7436378E-05 v, j, mj = 0 4 -4 0 0.7929087E-10 1 0.1292394E-04 2 0.1695465E-04 3 0.5236046E-05 4 0.7590929E-05 5 0.2125199E-04 6 0.1452090E-04 7 0.5224901E-05 8 0.7004403E-06 9 0.1882669E-07 v, j, mj = 0 4 -3 0 0.2590214E-07 1 0.4776935E-05 2 0.9052198E-05 3 0.2028847E-04 4 0.2298219E-04 5 0.1055658E-04 6 0.4549282E-05 7 0.7407649E-06 8 0.5908152E-07 9 0.2317686E-08 v, j, mj = 0 4 -2 0 0.2662869E-11 1 0.4198828E-05 2 0.5863898E-05 3 0.2394921E-04 4 0.5174015E-04 5 0.2224722E-04 6 0.5420192E-05 7 0.1273690E-05 8 0.1806333E-06 9 0.9181562E-08 v, j, mj = 0 4 -1 0 0.1855446E-11 1 0.6066745E-05 2 0.1036852E-04 3 0.5023607E-04 4 0.4489312E-04 5 0.1547315E-04 6 0.1437857E-05 7 0.7760770E-06 8 0.1349668E-06 9 0.6324405E-08 v, j, mj = 0 4 0 0 0.2586665E-05 1 0.4011881E-05 2 0.2753762E-04 3 0.9665487E-04 4 0.4601900E-04 5 0.1542894E-04 6 0.5072691E-05 7 0.1958766E-05 8 0.4108840E-06 9 0.2033168E-07 v, j, mj = 0 4 1 0 0.9132503E-11 1 0.1421453E-04 2 0.3384218E-04 3 0.8722927E-04 4 0.4347970E-04 5 0.1864771E-04 6 0.1981647E-04 7 0.8481214E-05 8 0.1583229E-05 9 0.3318205E-07 v, j, mj = 0 4 2 0 0.2070519E-11 1 0.2109683E-04 2 0.1578713E-03 3 0.2617844E-03 4 0.2015955E-03 5 0.1709055E-03 6 0.1120113E-03 7 0.4568246E-04 8 0.6479778E-05 9 0.1901104E-06 v, j, mj = 0 4 3 0 0.3449309E-07 1 0.1179506E-04 2 0.1172769E-03 3 0.4604480E-03 4 0.2705023E-03 5 0.7761622E-04 6 0.1869149E-03 7 0.1187844E-03 8 0.1478008E-04 9 0.1426826E-06 v, j, mj = 0 4 4 0 0.1582463E-10 1 0.3270877E-04 2 0.1136070E-03 3 0.8188961E-04 4 0.1078141E-03 5 0.2284987E-03 6 0.6928461E-03 7 0.5096160E-03 8 0.9441049E-04 9 0.2214014E-05 v, j, mj = 0 6 -6 0 0.4806611E-05 1 0.2682831E-05 2 0.4443521E-05 3 0.2680875E-05 4 0.3085328E-05 5 0.3594431E-05 6 0.1796965E-05 7 0.2516813E-06 8 0.4698930E-08 9 0.1361471E-09 v, j, mj = 0 6 -5 0 0.4591000E-11 1 0.3855389E-06 2 0.3526775E-05 3 0.2631732E-05 4 0.2901874E-05 5 0.1524459E-05 6 0.7563779E-06 7 0.7365874E-07 8 0.9272085E-09 9 0.3353713E-09 v, j, mj = 0 6 -4 0 0.3270265E-11 1 0.1577459E-05 2 0.3898047E-05 3 0.3448860E-05 4 0.3730402E-05 5 0.1301040E-05 6 0.1149831E-06 7 0.7398644E-08 8 0.1092722E-08 9 0.5393149E-09 v, j, mj = 0 6 -3 0 0.3772394E-08 1 0.3786417E-06 2 0.1739126E-05 3 0.3426593E-05 4 0.6106068E-05 5 0.1219923E-05 6 0.2754003E-07 7 0.3506447E-08 8 0.8774316E-09 9 0.4025168E-09 v, j, mj = 0 6 -2 0 0.1224205E-11 1 0.6742777E-05 2 0.1258147E-05 3 0.2127264E-04 4 0.1690954E-04 5 0.1209309E-05 6 0.4223806E-07 7 0.9994789E-08 8 0.3040863E-08 9 0.7615827E-09 v, j, mj = 0 6 -1 0 0.3309540E-12 1 0.6004971E-05 2 0.2536193E-04 3 0.1333227E-03 4 0.3946082E-04 5 0.1239421E-05 6 0.4051773E-07 7 0.1042234E-07 8 0.5806543E-08 9 0.5506155E-09 v, j, mj = 0 6 0 0 0.2944158E-04 1 0.8764565E-05 2 0.1857522E-03 3 0.5059238E-03 4 0.4016225E-04 5 0.1417776E-05 6 0.1559241E-06 7 0.4144885E-07 8 0.5466837E-08 9 0.1140197E-08 v, j, mj = 0 6 1 0 0.4503630E-12 1 0.2495286E-04 2 0.1244424E-02 3 0.8040306E-03 4 0.2168696E-04 5 0.6754596E-05 6 0.1242775E-05 7 0.2041706E-06 8 0.1355118E-07 9 0.2078050E-08 v, j, mj = 0 6 2 0 0.1168521E-10 1 0.2685260E-03 2 0.1918885E-02 3 0.2880830E-03 4 0.1621529E-03 5 0.5077335E-04 6 0.1421643E-04 7 0.2321285E-05 8 0.7734139E-07 9 0.3452348E-08 v, j, mj = 0 6 3 0 0.1346312E-05 1 0.4581336E-03 2 0.3741096E-03 3 0.7453826E-03 4 0.5581326E-03 5 0.3731618E-03 6 0.1050800E-03 7 0.1169786E-04 8 0.4093239E-06 9 0.1109560E-07 v, j, mj = 0 6 4 0 0.6602190E-11 1 0.2585095E-02 2 0.3081338E-02 3 0.1196171E-02 4 0.1379298E-02 5 0.8725699E-03 6 0.3131067E-03 7 0.4114346E-04 8 0.1555250E-05 9 0.2518404E-07 v, j, mj = 0 6 5 0 0.2840992E-11 1 0.1995223E-02 2 0.1163399E-02 3 0.2171472E-02 4 0.5428838E-03 5 0.6171874E-03 6 0.7134062E-03 7 0.1160032E-03 8 0.3649462E-05 9 0.5799645E-07 v, j, mj = 0 6 6 0 0.5187125E-03 1 0.1393734E-02 2 0.4023222E-03 3 0.2850073E-03 4 0.1114374E-02 5 0.3161155E-02 6 0.2670881E-02 7 0.5135761E-03 8 0.1437474E-04 9 0.5382465E-07 v, j, mj = 0 8 -8 0 0.1520436E-11 1 0.1331195E-06 2 0.9383826E-07 3 0.8270542E-07 4 0.6468802E-07 5 0.3274436E-07 6 0.3261015E-08 7 0.5049054E-10 8 0.2788240E-10 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1766079E-12 1 0.5105219E-08 2 0.1218883E-07 3 0.2287209E-07 4 0.3611958E-07 5 0.2075286E-07 6 0.1495713E-08 7 0.5608428E-10 8 0.2138853E-10 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.2847091E-07 1 0.2618947E-07 2 0.4995577E-07 3 0.6022422E-07 4 0.5528472E-07 5 0.1266814E-07 6 0.1113537E-08 7 0.3409302E-10 8 0.4438216E-10 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.6746344E-12 1 0.6150086E-08 2 0.3947867E-07 3 0.4035626E-07 4 0.2706009E-07 5 0.3160470E-08 6 0.5081422E-09 7 0.3965985E-10 8 0.2799592E-10 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.2803995E-12 1 0.7946178E-08 2 0.1281886E-07 3 0.2185211E-07 4 0.1679973E-07 5 0.3772000E-08 6 0.3231076E-09 7 0.1034707E-09 8 0.6984561E-10 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.9112475E-10 1 0.1385066E-07 2 0.3558054E-08 3 0.5563462E-07 4 0.3399963E-07 5 0.9205826E-08 6 0.1276914E-08 7 0.2438802E-09 8 0.1587941E-09 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.4586362E-13 1 0.1131850E-07 2 0.2609720E-06 3 0.5249437E-06 4 0.2953817E-06 5 0.2477700E-07 6 0.2263037E-08 7 0.1009586E-08 8 0.4566351E-09 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.1044772E-12 1 0.4008194E-06 2 0.1776788E-05 3 0.7492161E-05 4 0.3148842E-05 5 0.6792489E-07 6 0.6541507E-08 7 0.4247808E-08 8 0.1093264E-08 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.1577071E-05 1 0.2442278E-05 2 0.2555416E-04 3 0.1317144E-03 4 0.2502946E-04 5 0.6778193E-06 6 0.9778163E-08 7 0.9193707E-08 8 0.3462196E-08 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.1158908E-11 1 0.3945582E-04 2 0.7837139E-03 3 0.1205931E-02 4 0.1446365E-03 5 0.5304894E-05 6 0.1064451E-06 7 0.3229967E-07 8 0.3254336E-08 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.5340904E-10 1 0.1027547E-03 2 0.9754116E-02 3 0.5826775E-02 4 0.5658892E-03 5 0.2687107E-04 6 0.9542336E-06 7 0.2888498E-07 8 0.6249155E-08 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.1327816E-04 1 0.8784174E-02 2 0.4069884E-01 3 0.1533772E-01 4 0.1208707E-02 5 0.1225289E-03 6 0.6546080E-05 7 0.1926412E-06 8 0.6524807E-08 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.4576565E-10 1 0.2510992E-01 2 0.5891912E-01 3 0.1575921E-01 4 0.2422572E-02 5 0.6535429E-03 6 0.3758063E-04 7 0.7285418E-06 8 0.1497366E-07 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.4221174E-12 1 0.7323676E-02 2 0.4325420E-01 3 0.4339022E-02 4 0.1363503E-01 5 0.2945676E-02 6 0.1638717E-03 7 0.1954755E-05 8 0.8932759E-08 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.9119340E-01 1 0.3223616E-01 2 0.2656759E-01 3 0.6011580E-01 4 0.3360300E-01 5 0.6951088E-02 6 0.3955824E-03 7 0.4747845E-05 8 0.2611314E-07 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1367852E-11 1 0.2161085E-01 2 0.5928355E-01 3 0.7193693E-01 4 0.1821009E-02 5 0.7747107E-02 6 0.1008888E-02 7 0.1162678E-04 8 0.2075346E-07 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.1291422E-09 1 0.2006324E-01 2 0.3690525E-01 3 0.4257884E-01 4 0.7162368E-01 5 0.4766916E-01 6 0.4627422E-02 7 0.4811489E-04 8 0.3506185E-07 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.2741269E-13 1 0.2411922E-11 2 0.1043230E-10 3 0.4772761E-11 4 0.6498982E-11 5 0.3480485E-11 6 0.2344369E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.8806557E-13 1 0.2083392E-11 2 0.1194739E-10 3 0.6210928E-11 4 0.7375677E-11 5 0.6869942E-11 6 0.7383235E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.1104718E-13 1 0.2848795E-12 2 0.1855721E-10 3 0.1128460E-10 4 0.9080687E-11 5 0.1064946E-10 6 0.6397674E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.1547869E-13 1 0.7785451E-11 2 0.9973187E-11 3 0.6321555E-11 4 0.8103840E-11 5 0.9407013E-11 6 0.6284912E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.6533188E-11 1 0.9336072E-11 2 0.3084653E-10 3 0.1706601E-10 4 0.6046886E-11 5 0.7378090E-11 6 0.3376014E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.4310251E-14 1 0.1641197E-10 2 0.8836993E-10 3 0.7712355E-10 4 0.2148901E-10 5 0.1554864E-10 6 0.7341592E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.2007997E-14 1 0.1192539E-10 2 0.1212775E-09 3 0.2403084E-09 4 0.1021118E-09 5 0.9176716E-10 6 0.1883936E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.1154428E-10 1 0.5908114E-09 2 0.7278711E-09 3 0.5246601E-09 4 0.6163405E-09 5 0.2329630E-09 6 0.6045497E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.9741043E-16 1 0.9311120E-09 2 0.2871018E-08 3 0.2182209E-08 4 0.8549176E-09 5 0.1018340E-08 6 0.7132594E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.1470814E-15 1 0.3646749E-08 2 0.1686187E-08 3 0.3904198E-08 4 0.1269129E-08 5 0.1698613E-08 6 0.4712194E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.4604632E-08 1 0.4659887E-08 2 0.1670713E-07 3 0.2473431E-07 4 0.1430470E-07 5 0.1214428E-07 6 0.6730217E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.8710932E-15 1 0.2326487E-07 2 0.2460576E-06 3 0.2694402E-06 4 0.3920533E-07 5 0.6650446E-08 6 0.5197647E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.8166651E-14 1 0.4219952E-07 2 0.1600405E-05 3 0.6959262E-06 4 0.4084304E-07 5 0.3564766E-07 6 0.3434902E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.1502204E-07 1 0.8675097E-06 2 0.3589813E-05 3 0.4343591E-06 4 0.8942093E-07 5 0.3923816E-07 6 0.8507490E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.8582866E-15 1 0.3003305E-05 2 0.7332253E-05 3 0.9060151E-06 4 0.5133367E-07 5 0.2630532E-07 6 0.8066863E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.9539095E-15 1 0.9684333E-04 2 0.5518788E-04 3 0.5740414E-05 4 0.1385611E-06 5 0.7852681E-07 6 0.8526844E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.3720637E-04 1 0.8188943E-04 2 0.2405524E-04 3 0.1886251E-05 4 0.1863184E-06 5 0.9856644E-07 6 0.6121532E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.4317168E-14 1 0.6031698E-04 2 0.3155750E-04 3 0.2112107E-05 4 0.3170778E-06 5 0.6280821E-07 6 0.1773084E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.1283065E-12 1 0.8510363E-05 2 0.1027986E-05 3 0.1836845E-05 4 0.6184023E-06 5 0.8891954E-07 6 0.1139648E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.6290724E-07 1 0.8522860E-06 2 0.8096169E-06 3 0.3785958E-06 4 0.2911940E-06 5 0.8241165E-07 6 0.4696459E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.1043534E-13 1 0.4269155E-06 2 0.1225271E-05 3 0.1260555E-05 4 0.3478343E-06 5 0.1502204E-06 6 0.3805354E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.2014379E-05 1 0.7932679E-06 2 0.3483952E-05 3 0.1246735E-04 4 0.2680109E-04 5 0.2931147E-04 6 0.4135755E-05 7 0.5274091E-07 8 0.6027764E-09 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.2433063E-10 1 0.3962124E-05 2 0.2525292E-05 3 0.5463104E-05 4 0.2072914E-04 5 0.2203009E-04 6 0.1352002E-05 7 0.5055260E-08 8 0.2012762E-09 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.2731846E-11 1 0.6165407E-07 2 0.2301140E-05 3 0.5454418E-05 4 0.5746904E-05 5 0.1699962E-05 6 0.8118464E-07 7 0.1996194E-08 8 0.2995247E-09 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.1088958E-05 1 0.1423310E-05 2 0.3841345E-05 3 0.3984463E-05 4 0.8090592E-05 5 0.1830938E-04 6 0.2288013E-05 7 0.1202305E-07 8 0.2564001E-09 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.5754737E-12 1 0.1597400E-05 2 0.2496273E-04 3 0.1200769E-04 4 0.4333555E-04 5 0.1531768E-04 6 0.1971039E-06 7 0.3207234E-08 8 0.8858071E-09 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.1148630E-10 1 0.1006738E-04 2 0.2563933E-04 3 0.3665444E-04 4 0.9382921E-04 5 0.1594214E-03 6 0.1215774E-04 7 0.6608469E-07 8 0.8636237E-09 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.1109760E-12 1 0.4190539E-06 2 0.2662453E-06 3 0.2533452E-05 4 0.1059218E-04 5 0.1246852E-05 6 0.9097916E-08 7 0.1140002E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.3085493E-09 1 0.8322024E-08 2 0.2528151E-07 3 0.3230539E-05 4 0.2158075E-05 5 0.7709891E-07 6 0.2236370E-08 7 0.1817798E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.3844065E-11 1 0.3744273E-06 2 0.3760571E-06 3 0.1315552E-05 4 0.4449247E-06 5 0.5510385E-06 6 0.1603285E-07 7 0.1147502E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.3675651E-12 1 0.1273345E-06 2 0.4987291E-06 3 0.9991077E-06 4 0.6539381E-06 5 0.1057851E-06 6 0.2799075E-08 7 0.3618112E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.5148435E-07 1 0.9338396E-07 2 0.2087108E-05 3 0.4053127E-05 4 0.4751410E-06 5 0.4278415E-06 6 0.2415880E-07 7 0.1095301E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.5219309E-12 1 0.5176602E-06 2 0.4493155E-04 3 0.1617255E-04 4 0.5147660E-05 5 0.8307976E-06 6 0.1236949E-07 7 0.1924286E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.4198791E-11 1 0.1572056E-04 2 0.1782043E-03 3 0.1181439E-03 4 0.4595717E-04 5 0.4708615E-05 6 0.8199232E-07 7 0.2555640E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.4462048E-06 1 0.1899754E-03 2 0.2953743E-03 3 0.3368416E-03 4 0.1370622E-03 5 0.1134505E-04 6 0.1029261E-06 7 0.1596956E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.2366784E-11 1 0.2304556E-03 2 0.4667855E-04 3 0.5625593E-04 4 0.4411640E-03 5 0.6079730E-04 6 0.4612851E-06 7 0.3747017E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.4570309E-08 1 0.4125137E-08 2 0.3803539E-07 3 0.1203711E-07 4 0.3735348E-09 5 0.1325169E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.2741543E-12 1 0.1352136E-07 2 0.9370990E-08 3 0.5450675E-08 4 0.7235408E-09 5 0.2495143E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.9030162E-13 1 0.7445378E-10 2 0.5492299E-08 3 0.6700483E-08 4 0.2397412E-08 5 0.8067809E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.4290681E-11 1 0.4344477E-10 2 0.2982538E-08 3 0.6025553E-08 4 0.7543428E-09 5 0.6664195E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.7763597E-14 1 0.7245756E-09 2 0.1429244E-08 3 0.3718714E-08 4 0.5981157E-09 5 0.2052491E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.4781556E-14 1 0.5774693E-09 2 0.5361757E-08 3 0.1992827E-08 4 0.3948839E-09 5 0.3312767E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.3459087E-08 1 0.4035184E-08 2 0.1804079E-07 3 0.8022878E-08 4 0.2464224E-08 5 0.1720313E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.4390415E-14 1 0.3550128E-08 2 0.1576728E-06 3 0.7725300E-07 4 0.1119755E-07 5 0.2111952E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.1183886E-12 1 0.2015194E-06 2 0.1090027E-05 3 0.2031599E-06 4 0.2332999E-07 5 0.3569093E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.1093109E-07 1 0.5011577E-05 2 0.2617709E-04 3 0.7324598E-05 4 0.3634013E-06 5 0.2407788E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.4683212E-11 1 0.1259239E-03 2 0.3423661E-03 3 0.7189762E-04 4 0.1768823E-05 5 0.3051538E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.2490311E-12 1 0.1681418E-02 2 0.1216916E-02 3 0.8551893E-04 4 0.7926442E-06 5 0.1830489E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.2983017E-02 1 0.8077443E-02 2 0.4228008E-02 3 0.6569870E-03 4 0.1410792E-04 5 0.5048058E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -8 0 0.2449246E-15 1 0.3198963E-13 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 0.6669368E-16 1 0.2407511E-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 0.5919350E-12 1 0.8689897E-14 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 0.4067118E-18 1 0.6371901E-13 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 0.1139873E-17 1 0.1488370E-13 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 0.1680646E-12 1 0.1871040E-13 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 0.1388722E-17 1 0.4386504E-13 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 0.5633746E-18 1 0.1120848E-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 0 0 0.6042167E-11 1 0.7500865E-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 1 0 0.2026904E-17 1 0.8621176E-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 2 0 0.5489574E-18 1 0.1060214E-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 0.1157124E-09 1 0.1110197E-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 0.2203084E-16 1 0.1633529E-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 5 0 0.6486993E-17 1 0.1772722E-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 6 0 0.7473244E-09 1 0.3798375E-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 7 0 0.2449054E-16 1 0.4029525E-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 8 0 0.1563505E-15 1 0.1383362E-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 sum of the probabilities = 0.9623542 average vibrational energy (ev) = 0.011870 average rotational energy (ev) = 0.479941 average diffraction energy (ev) = 0.055267 the reaction probability = 0.3764578D-01 etrans(icomin)= 0.151114 etrans(icomax)= 0.548327 etrans= 0.550000 CPU TIMES Total computation 165898.6902 (a) ... Propagating the wavefunction 162753.6502 (b) Setup time 2681.8455 Saving the wave function for rerun 124.8594 Calculating averages 8.9050 Calculating and saving BK-coeffs 40.9734 Asymptotic analysis 8.0087 Saving the flux coefficients 0.0000 Flux analysis 0.0000 ----------------------------------------------------- Sum 165618.2423 (a) ... FFTs along X and Y 7313.3527 Kinetic energy operation along Z 41036.0916 Kinetic energy operation along r 35695.9342 Potential energy multiplication 18694.8037 Legengre transforms 48856.3483 Shifting the wavefunction 4197.7595 Kinetic energy multiplications (xy) 804.0158 Absorbing the wavefunction 931.0957 Projection formalism 20.6059 Operations on specular grid 0.1824 ----------------------------------------------------- Sum 157550.1898 (b) ... Potential initialisation time 0.0000 Potential setup time 2599.9126 FFTs along X 3947.0857 FFTs along Y 3366.2669 Time spent on FGH for asympwf 0.5080 Ending date and time: Thu Aug 15 09:51:44 CEST 2019