Starting date and time: Sun Aug 11 13:28:34 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 20190811 at 132834.591 *** * 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: v0j8mj2-0.15eV-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: 2 * 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: 2 * 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 = 2 ... *** 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 = 0.27179718E-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 = 144 iz = 148 iz = 152 iz = 156 iz = 160 iz = 145 iz = 149 iz = 143 iz = 153 iz = 157 iz = 161 iz = 146 iz = 150 iz = 154 iz = 158 iz = 162 iz = 147 iz = 151 iz = 155 iz = 159 Saving Cu111_B86SRP68-DF2_Z8A_C3v PES into file : ./Cu111_B86SRP68-DF2_Z8A_C3v_162_-1.000_0.100_56_0.800_0.150_20_20_4.864_32_32. pes WARNING in routine SetupThePES in module Potential: vdvr contains more indices than can be represented by a four byte integer. Therefore the result of the inquiry 'SIZE(vdvr)' will be wrong! Program continues with dirty trick fix. Beware! * Imposing a maximum on the potential; vmax (eV) = 0.10000000E+02 Total time setting up the potential = 0.26101409E+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 = 309 ******************************************************************************** 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 = 15719 ******************************************************************************** INFO FROM SETTING UP THE OPTICAL POTENTIALS ******************************************************************************** * Optical potential in Z absorbs with coefficient: 0.83111374E-02 * Optical potential in r absorbs with coefficient: 0.93569763E-02 * Optical potential in Z specular absorbs with coefficient: 0.64071284E-02 ******************************************************************************** INFO FROM SETTING UP THE GRID ENERGIES ******************************************************************************** * Maximum diffraction order included on the momentum grid = 0 * Number of diffraction channels included = 0 * Number of diffraction channels excluded = 0 * initial parallel energy (eV) = 0.00000000E+00 ******************************************************************************** INFO FROM SETTING UP THE KINETIC ENERGY OPERATORS ******************************************************************************** ******************************************************************************** INFO FROM SETTING UP THE WAVE FUNCTION ******************************************************************************** * Norm initial wave packet (Z,r) = 0.10000000E+01 * Absolute value of the wave function in momentum space: - at k = 0 0.20426229E-04 - at the end/beginning of the grid 0.20158188E-14 - maximum value = 0.52335254E+00 * Grid point boundaries between which initial wave packet must be located: - Low boundary (asymptotic value of Z), iLow = 163 - High boundary (start of opt. pot on spec. grid), iHigh = 208 * Norm of the initial wave packet between iLow and iHigh = 0.10000000E+01 ******************************************************************************** INFO FROM SETTING UP THE ANALYSIS ******************************************************************************** * Tolerance for fixing the dynamical analysis surface on the specular grid = 0.10000000E-08 * Maximum j in analysis: jana = 12 * Maximum v in analysis: nviba = 3 * Maximum diffraction order in analysis: mdifa = 9 ******************************************************************************** INFO FROM SETTING UP THE SPLIT OPERATOR PROPAGATOR ******************************************************************************** ----- Split operator propagator set up ----- ******************************************************************************** INFO ON PROPAGATING THE WAVE PACKET ******************************************************************************** time norm z r rest norm 0.00000000E+00 1.00000000 17.40000000 1.53574968 0.10000000E+01 0.50000000E+02 0.99999999 17.27377086 1.53575595 0.99999999E+00 0.10000000E+03 0.99999998 17.14754172 1.53576245 0.99999997E+00 0.15000000E+03 0.99999998 17.02131258 1.53576358 0.99999980E+00 0.20000000E+03 0.99999997 16.89508344 1.53576327 0.99999855E+00 0.25000000E+03 0.99999996 16.76885430 1.53576208 0.99998985E+00 0.30000000E+03 0.99999995 16.64262516 1.53575699 0.99993931E+00 0.35000000E+03 0.99999994 16.51639602 1.53575039 0.99969724E+00 0.40000000E+03 0.99999993 16.39016687 1.53575402 0.99874791E+00 0.45000000E+03 0.99999993 16.26393773 1.53576283 0.99569675E+00 0.50000000E+03 0.99999992 16.13770858 1.53576403 0.98760724E+00 0.55000000E+03 0.99999991 16.01147941 1.53576306 0.96972261E+00 0.60000000E+03 0.99999990 15.88525016 1.53576173 0.93629620E+00 0.65000000E+03 0.99999989 15.75902072 1.53575759 0.88265997E+00 0.70000000E+03 0.99999989 15.63279086 1.53575147 0.80756273E+00 0.75000000E+03 0.99999988 15.50656013 1.53575255 0.71431863E+00 0.80000000E+03 0.99999987 15.38032789 1.53576231 0.61003008E+00 0.85000000E+03 0.99999986 15.25409318 1.53576495 0.50340989E+00 0.90000000E+03 0.99999985 15.12785481 1.53576291 0.40241938E+00 0.95000000E+03 0.99999984 15.00161134 1.53576136 0.31270931E+00 0.10000000E+04 0.99999984 14.87536121 1.53575794 0.23716178E+00 0.10500000E+04 0.99999983 14.74910281 1.53575248 0.17627134E+00 0.11000000E+04 0.99999982 14.62283452 1.53575195 0.12891004E+00 0.11500000E+04 0.99999981 14.49655480 1.53576079 0.93104775E-01 0.12000000E+04 0.99999980 14.37026218 1.53576638 0.66633383E-01 0.12500000E+04 0.99999979 14.24395525 1.53576299 0.47394719E-01 0.13000000E+04 0.99999979 14.11763261 1.53576159 0.33589151E-01 0.13500000E+04 0.99999978 13.99129287 1.53575904 0.23771132E-01 0.14000000E+04 0.99999977 13.86493454 1.53575534 0.16830009E-01 0.14500000E+04 0.99999976 13.73855598 1.53575551 0.11939073E-01 0.15000000E+04 0.99999975 13.61215535 1.53576533 0.84968641E-02 0.15500000E+04 0.99999975 13.48573055 1.53577676 0.60728911E-02 0.16000000E+04 0.99999974 13.35927915 1.53577926 0.43625372E-02 0.16500000E+04 0.99999973 13.23279836 1.53578301 0.31518931E-02 0.17000000E+04 0.99999972 13.10628500 1.53579092 0.22914455E-02 0.17500000E+04 0.99999971 12.97973547 1.53579881 0.16769331E-02 0.18000000E+04 0.99999970 12.85314575 1.53581231 0.12356814E-02 0.18500000E+04 0.99999970 12.72651144 1.53583651 0.91698055E-03 0.19000000E+04 0.99999969 12.59982777 1.53586679 0.68536712E-03 0.19500000E+04 0.99999968 12.47308965 1.53589112 0.51596038E-03 0.20000000E+04 0.99999967 12.34629172 1.53591402 0.39123508E-03 0.20500000E+04 0.99999966 12.21942841 1.53594495 0.29879180E-03 0.21000000E+04 0.99999965 12.09249394 1.53597682 0.22981311E-03 0.21500000E+04 0.99999965 11.96548242 1.53601348 0.17799620E-03 0.22000000E+04 0.99999964 11.83838786 1.53605954 0.13881056E-03 0.22500000E+04 0.99999963 11.71120416 1.53611278 0.10898062E-03 0.23000000E+04 0.99999962 11.58392516 1.53616108 0.86124808E-04 0.23500000E+04 0.99999961 11.45654465 1.53620383 0.68500110E-04 0.24000000E+04 0.99999961 11.32905635 1.53625298 0.54823669E-04 0.24500000E+04 0.99999960 11.20145395 1.53630525 0.44145478E-04 0.25000000E+04 0.99999959 11.07373111 1.53635798 0.35757829E-04 0.25500000E+04 0.99999958 10.94588145 1.53641948 0.29130431E-04 0.26000000E+04 0.99999957 10.81789862 1.53648675 0.23863638E-04 0.26500000E+04 0.99999956 10.68977634 1.53655135 0.19654310E-04 0.27000000E+04 0.99999956 10.56150843 1.53660786 0.16272124E-04 0.27500000E+04 0.99999955 10.43308890 1.53666799 0.13539926E-04 0.28000000E+04 0.99999954 10.30451207 1.53673505 0.11321446E-04 0.28500000E+04 0.99999953 10.17577266 1.53680167 0.95111299E-05 0.29000000E+04 0.99999952 10.04686597 1.53687581 0.80267753E-05 0.29500000E+04 0.99999952 9.91778801 1.53695831 0.68038115E-05 0.30000000E+04 0.99999951 9.78853576 1.53704081 0.57920589E-05 0.30500000E+04 0.99999950 9.65910736 1.53711786 0.49512356E-05 0.31000000E+04 0.99999949 9.52950239 1.53719798 0.42495009E-05 0.31500000E+04 0.99999948 9.39972219 1.53729059 0.36614270E-05 0.32000000E+04 0.99999947 9.26977018 1.53738979 0.31666331E-05 0.32500000E+04 0.99999947 9.13965222 1.53749839 0.27487164E-05 0.33000000E+04 0.99999946 9.00937704 1.53762487 0.23944022E-05 0.33500000E+04 0.99999945 8.87895667 1.53776148 0.20928811E-05 0.34000000E+04 0.99999944 8.74840695 1.53790535 0.18353192E-05 0.34500000E+04 0.99999943 8.61774799 1.53806295 0.16145006E-05 0.35000000E+04 0.99999942 8.48700475 1.53824988 0.14245423E-05 0.35500000E+04 0.99999941 8.35620762 1.53846629 0.12603984E-05 0.36000000E+04 0.99999941 8.22539298 1.53871298 0.11185691E-05 0.36500000E+04 0.99999940 8.09460386 1.53900331 0.99546657E-06 0.37000000E+04 0.99999939 7.96389051 1.53933827 0.88827724E-06 0.37500000E+04 0.99999938 7.83331110 1.53971523 0.79464720E-06 0.38000000E+04 0.99999937 7.70293227 1.54014482 0.71262611E-06 0.38500000E+04 0.99999936 7.57282979 1.54064396 0.64059738E-06 0.39000000E+04 0.99999935 7.44308907 1.54122370 0.57720414E-06 0.39500000E+04 0.99999933 7.31380570 1.54188327 0.52108703E-06 0.40000000E+04 0.99999932 7.18508590 1.54263526 0.47167538E-06 0.40500000E+04 0.99999929 7.05704682 1.54348817 0.42790583E-06 0.41000000E+04 0.99999926 6.92981685 1.54443648 0.38902847E-06 0.41500000E+04 0.99999921 6.80353572 1.54548564 0.35437432E-06 0.42000000E+04 0.99999913 6.67835448 1.54664656 0.32336547E-06 0.42500000E+04 0.99999901 6.55443539 1.54792559 0.29554253E-06 0.43000000E+04 0.99999884 6.43195153 1.54931499 0.27056986E-06 0.43500000E+04 0.99999858 6.31108640 1.55080800 0.24799946E-06 0.44000000E+04 0.99999820 6.19203322 1.55240239 0.22798416E-06 0.44500000E+04 0.99999766 6.07499417 1.55408035 0.21004626E-06 0.45000000E+04 0.99999691 5.96017939 1.55582342 0.19388631E-06 0.45500000E+04 0.99999588 5.84780591 1.55762388 0.17923010E-06 0.46000000E+04 0.99999449 5.73809634 1.55946922 0.16587115E-06 0.46500000E+04 0.99999265 5.63127746 1.56133903 0.15367498E-06 0.47000000E+04 0.99999027 5.52757865 1.56320758 0.14255116E-06 0.47500000E+04 0.99998721 5.42723019 1.56505772 0.13242067E-06 0.48000000E+04 0.99998337 5.33046146 1.56686792 0.12320125E-06 0.48500000E+04 0.99997863 5.23749913 1.56861254 0.11481026E-06 0.49000000E+04 0.99997285 5.14856513 1.57027736 0.10716957E-06 0.49500000E+04 0.99996592 5.06387477 1.57185294 0.10020461E-06 0.50000000E+04 0.99995773 4.98363479 1.57332528 0.93635856E-07 0.50500000E+04 0.99994819 4.90804151 1.57467821 0.87808488E-07 0.51000000E+04 0.99993722 4.83727910 1.57589912 0.82442997E-07 0.51500000E+04 0.99992478 4.77151806 1.57697893 0.77477043E-07 0.52000000E+04 0.99991085 4.71091388 1.57790321 0.72862133E-07 0.52500000E+04 0.99989545 4.65560588 1.57866292 0.68563054E-07 0.53000000E+04 0.99987863 4.60571635 1.57925647 0.64556840E-07 0.53500000E+04 0.99986048 4.56134987 1.57968173 0.60819442E-07 0.54000000E+04 0.99984109 4.52259271 1.57993657 0.57338764E-07 0.54500000E+04 0.99982061 4.48951262 1.58002229 0.54102498E-07 0.55000000E+04 0.99979920 4.46215859 1.57994567 0.51086178E-07 0.55500000E+04 0.99977701 4.44056096 1.57971326 0.48114736E-07 0.56000000E+04 0.99975424 4.42473163 1.57933200 0.45541780E-07 0.56500000E+04 0.99973107 4.41466453 1.57881394 0.43142103E-07 0.57000000E+04 0.99970768 4.41033619 1.57817085 0.40965737E-07 0.57500000E+04 0.99968426 4.41170662 1.57741189 0.38958050E-07 0.58000000E+04 0.99966098 4.41872018 1.57654632 0.37021294E-07 0.58500000E+04 0.99963802 4.43130669 1.57558485 0.35276720E-07 0.59000000E+04 0.99961554 4.44938248 1.57453871 0.33696749E-07 0.59500000E+04 0.99959368 4.47285159 1.57341781 0.32054015E-07 0.60000000E+04 0.99957259 4.50160685 1.57223430 0.30514684E-07 0.60500000E+04 0.99955238 4.53553106 1.57100098 0.29276993E-07 0.61000000E+04 0.99953316 4.57449803 1.56972813 0.27914583E-07 0.61500000E+04 0.99951498 4.61837368 1.56842462 0.26293670E-07 0.62000000E+04 0.99949792 4.66701702 1.56709894 0.25317835E-07 0.62500000E+04 0.99948200 4.72028119 1.56575904 0.24732309E-07 0.63000000E+04 0.99946724 4.77801432 1.56441201 0.23179118E-07 0.63500000E+04 0.99945363 4.84006049 1.56306573 0.21411794E-07 0.64000000E+04 0.99944114 4.90626048 1.56172998 0.22335565E-07 0.64500000E+04 0.99942975 4.97645264 1.56041360 0.23423027E-07 0.65000000E+04 0.99941941 5.05047368 1.55912345 0.21002564E-07 0.65500000E+04 0.99941005 5.12815946 1.55786405 0.20962699E-07 ==> ZAnalysis on specular channel fixed at Z = 0.16800000E+02 0.66000000E+04 0.99940160 5.20934581 1.55663703 0.28526282E-07 0.66500000E+04 0.99939397 5.29386926 1.55544204 0.34191745E-07 0.67000000E+04 0.99938707 5.38156779 1.55427929 0.33981642E-07 0.67500000E+04 0.99938077 5.47228139 1.55315226 0.42699658E-07 0.68000000E+04 0.99937495 5.56585250 1.55206691 0.66422873E-07 0.68500000E+04 0.99936943 5.66212641 1.55102893 0.88067337E-07 0.69000000E+04 0.99936402 5.76095146 1.55004137 0.10075949E-06 0.69500000E+04 0.99935846 5.86217931 1.54910255 0.12431414E-06 0.70000000E+04 0.99935244 5.96566507 1.54820638 0.17039898E-06 0.70500000E+04 0.99934555 6.07126736 1.54734603 0.22100329E-06 0.71000000E+04 0.99933724 6.17884835 1.54651844 0.25837540E-06 0.71500000E+04 0.99932685 6.28827359 1.54572626 0.29304706E-06 0.72000000E+04 0.99931348 6.39941182 1.54497565 0.34568309E-06 0.72500000E+04 0.99929600 6.51213461 1.54427205 0.41450313E-06 0.73000000E+04 0.99927299 6.62631603 1.54361610 0.47636085E-06 0.73500000E+04 0.99924270 6.74183227 1.54300202 0.51736885E-06 0.74000000E+04 0.99920298 6.85856132 1.54242081 0.54896188E-06 0.74500000E+04 0.99915125 6.97638263 1.54186572 0.58779756E-06 0.75000000E+04 0.99908449 7.09517699 1.54133609 0.62803845E-06 0.75500000E+04 0.99899917 7.21482629 1.54083661 0.64499824E-06 0.76000000E+04 0.99889128 7.33521361 1.54037294 0.62406563E-06 0.76500000E+04 0.99875630 7.45622323 1.53994676 0.57364427E-06 0.77000000E+04 0.99858925 7.57774083 1.53955347 0.50872413E-06 0.77500000E+04 0.99838466 7.69965379 1.53918460 0.43836559E-06 0.78000000E+04 0.99813665 7.82185146 1.53883333 0.38374278E-06 0.78500000E+04 0.99783895 7.94422559 1.53849891 0.40380264E-06 0.79000000E+04 0.99748495 8.06667073 1.53818654 0.59248711E-06 0.79500000E+04 0.99706779 8.18908473 1.53790280 0.10620989E-05 0.80000000E+04 0.99658041 8.31136931 1.53765000 0.19640749E-05 0.80500000E+04 0.99601568 8.43343069 1.53742364 0.35514906E-05 0.81000000E+04 0.99536645 8.55518029 1.53721477 0.62189861E-05 0.81500000E+04 0.99462571 8.67653543 1.53701591 0.10472817E-04 0.82000000E+04 0.99378666 8.79741993 1.53682599 0.16882690E-04 0.82500000E+04 0.99284283 8.91776461 1.53665067 0.26124486E-04 0.83000000E+04 0.99178816 9.03750761 1.53649760 0.39160647E-04 0.83500000E+04 0.99061698 9.15659438 1.53637011 0.57490864E-04 0.84000000E+04 0.98932411 9.27497743 1.53626408 0.83372313E-04 0.84500000E+04 0.98790472 9.39261578 1.53617041 0.11997161E-03 0.85000000E+04 0.98635433 9.50947409 1.53608100 0.17150131E-03 0.85500000E+04 0.98466865 9.62552166 1.53599414 0.24345370E-03 0.86000000E+04 0.98284349 9.74073138 1.53591518 0.34300058E-03 0.86500000E+04 0.98087465 9.85507875 1.53585195 0.47947158E-03 0.87000000E+04 0.97875784 9.96854108 1.53580812 0.66466919E-03 0.87500000E+04 0.97648862 10.08109705 1.53577966 0.91276809E-03 0.88000000E+04 0.97406248 10.19272668 1.53575731 0.12397402E-02 0.88500000E+04 0.97147488 10.30341169 1.53573289 0.16625642E-02 0.89000000E+04 0.96872143 10.41313620 1.53570482 0.21985954E-02 0.89500000E+04 0.96579804 10.52188765 1.53567905 0.28651901E-02 0.90000000E+04 0.96270116 10.62965787 1.53566449 0.36793348E-02 0.90500000E+04 0.95942793 10.73644398 1.53566601 0.46569712E-02 0.91000000E+04 0.95597637 10.84224915 1.53568016 0.58119255E-02 0.91500000E+04 0.95234545 10.94708300 1.53569735 0.71548042E-02 0.92000000E+04 0.94853517 11.05096172 1.53570840 0.86924251E-02 0.92500000E+04 0.94454654 11.15390782 1.53571043 0.10428007E-01 0.93000000E+04 0.94038159 11.25594972 1.53570839 0.12361977E-01 0.93500000E+04 0.93604322 11.35712110 1.53571110 0.14492988E-01 0.94000000E+04 0.93153519 11.45746025 1.53572453 0.16818457E-01 0.94500000E+04 0.92686201 11.55700942 1.53574713 0.19334349E-01 0.95000000E+04 0.92202883 11.65581417 1.53577128 0.22034424E-01 0.95500000E+04 0.91704143 11.75392288 1.53578958 0.24909150E-01 0.96000000E+04 0.91190608 11.85138629 1.53580026 0.27944727E-01 0.96500000E+04 0.90662959 11.94825721 1.53580831 0.31122510E-01 0.97000000E+04 0.90121922 12.04459025 1.53582147 0.34418799E-01 0.97500000E+04 0.89568268 12.14044163 1.53584380 0.37805084E-01 0.98000000E+04 0.89002810 12.23586892 1.53587147 0.41248852E-01 0.98500000E+04 0.88426392 12.33093061 1.53589482 0.44714673E-01 0.99000000E+04 0.87839876 12.42568546 1.53590570 0.48165612E-01 0.99500000E+04 0.87244120 12.52019151 1.53590380 0.51565063E-01 0.10000000E+05 0.86639947 12.61450463 1.53589745 0.54878753E-01 0.10050000E+05 0.86028107 12.70867691 1.53589851 0.58076824E-01 0.10100000E+05 0.85409239 12.80275471 1.53591437 0.61135657E-01 0.10150000E+05 0.84783830 12.89677678 1.53594222 0.64038841E-01 0.10200000E+05 0.84152187 12.99077263 1.53597029 0.66777089E-01 0.10250000E+05 0.83514413 13.08476128 1.53598602 0.69347147E-01 0.10300000E+05 0.82870410 13.17875068 1.53598463 0.71749752E-01 0.10350000E+05 0.82219896 13.27273790 1.53597181 0.73987236E-01 0.10400000E+05 0.81562437 13.36670998 1.53595980 0.76061452E-01 0.10450000E+05 0.80897500 13.46064543 1.53595922 0.77972328E-01 0.10500000E+05 0.80224513 13.55451615 1.53597190 0.79717450E-01 0.10550000E+05 0.79542920 13.64828938 1.53598989 0.81292563E-01 0.10600000E+05 0.78852236 13.74192961 1.53600191 0.82692573E-01 0.10650000E+05 0.78152073 13.83539985 1.53600183 0.83912783E-01 0.10700000E+05 0.77442158 13.92866242 1.53599233 0.84950108E-01 0.10750000E+05 0.76722315 14.02167893 1.53598218 0.85803882E-01 0.10800000E+05 0.75992442 14.11440963 1.53597970 0.86476254E-01 0.10850000E+05 0.75252459 14.20681233 1.53598622 0.86972095E-01 0.10900000E+05 0.74502271 14.29884108 1.53599482 0.87298463E-01 0.10950000E+05 0.73741725 14.39044498 1.53599603 0.87463920E-01 0.11000000E+05 0.72970583 14.48156723 1.53598594 0.87477937E-01 0.11050000E+05 0.72188518 14.57214483 1.53596965 0.87350446E-01 0.11100000E+05 0.71395123 14.66210873 1.53595774 0.87091598E-01 0.11150000E+05 0.70589938 14.75138465 1.53595892 0.86711498E-01 0.11200000E+05 0.69772490 14.83989436 1.53597300 0.86219826E-01 0.11250000E+05 0.68942336 14.92755729 1.53598938 0.85625509E-01 0.11300000E+05 0.68099102 15.01429239 1.53599388 0.84936533E-01 0.11350000E+05 0.67242524 15.10002003 1.53597921 0.84160005E-01 0.11400000E+05 0.66372470 15.18466388 1.53595096 0.83302406E-01 0.11450000E+05 0.65488963 15.26815263 1.53592445 0.82369842E-01 0.11500000E+05 0.64592183 15.35042161 1.53591515 0.81368142E-01 0.11550000E+05 0.63682468 15.43141398 1.53592828 0.80302894E-01 0.11600000E+05 0.62760302 15.51108175 1.53595391 0.79179494E-01 0.11650000E+05 0.61826302 15.58938633 1.53597268 0.78003337E-01 0.11700000E+05 0.60881201 15.66629861 1.53596905 0.76780065E-01 0.11750000E+05 0.59925824 15.74179867 1.53594213 0.75515622E-01 0.11800000E+05 0.58961073 15.81587505 1.53590645 0.74216026E-01 0.11850000E+05 0.57987904 15.88852359 1.53588278 0.72886960E-01 0.11900000E+05 0.57007315 15.95974612 1.53588494 0.71533426E-01 0.11950000E+05 0.56020328 16.02954900 1.53590994 0.70159685E-01 0.12000000E+05 0.55027978 16.09794168 1.53593912 0.68769502E-01 0.12050000E+05 0.54031308 16.16493552 1.53595091 0.67366483E-01 0.12100000E+05 0.53031361 16.23054280 1.53593529 0.65954279E-01 0.12150000E+05 0.52029175 16.29477619 1.53590003 0.64536488E-01 0.12200000E+05 0.51025786 16.35764851 1.53586533 0.63116355E-01 0.12250000E+05 0.50022216 16.41917291 1.53585114 0.61696520E-01 0.12300000E+05 0.49019482 16.47936325 1.53586413 0.60279040E-01 0.12350000E+05 0.48018587 16.53823463 1.53589286 0.58865651E-01 0.12400000E+05 0.47020517 16.59580394 1.53591635 0.57458095E-01 0.12450000E+05 0.46026240 16.65209030 1.53591871 0.56058280E-01 0.12500000E+05 0.45036700 16.70711533 1.53589867 0.54668218E-01 0.12550000E+05 0.44052816 16.76090317 1.53586885 0.53289814E-01 0.12600000E+05 0.43075475 16.81348026 1.53584690 0.51924723E-01 0.12650000E+05 0.42105530 16.86487496 1.53584382 0.50574382E-01 0.12700000E+05 0.41143795 16.91511700 1.53585657 0.49240234E-01 0.12750000E+05 0.40191046 16.96423690 1.53587164 0.47923905E-01 0.12800000E+05 0.39248011 17.01226546 1.53587670 0.46627163E-01 0.12850000E+05 0.38315377 17.05923322 1.53586892 0.45351625E-01 0.12900000E+05 0.37393779 17.10517018 1.53585512 0.44098371E-01 0.12950000E+05 0.36483802 17.15010550 1.53584571 0.42867721E-01 0.13000000E+05 0.35585980 17.19406739 1.53584659 0.41659324E-01 0.13050000E+05 0.34700796 17.23708295 1.53585372 0.40472558E-01 0.13100000E+05 0.33828678 17.27917817 1.53585594 0.39307030E-01 0.13150000E+05 0.32970007 17.32037789 1.53584572 0.38162919E-01 0.13200000E+05 0.32125116 17.36070582 1.53582643 0.37040977E-01 0.13250000E+05 0.31294296 17.40018456 1.53580992 0.35942241E-01 0.13300000E+05 0.30477795 17.43883569 1.53580822 0.34867605E-01 0.13350000E+05 0.29675827 17.47667990 1.53582477 0.33817468E-01 0.13400000E+05 0.28888572 17.51373716 1.53584954 0.32791609E-01 0.13450000E+05 0.28116178 17.55002690 1.53586355 0.31789326E-01 0.13500000E+05 0.27358761 17.58556817 1.53585292 0.30809762E-01 0.13550000E+05 0.26616410 17.62037986 1.53582043 0.29852266E-01 0.13600000E+05 0.25889182 17.65448070 1.53578367 0.28916611E-01 0.13650000E+05 0.25177107 17.68788933 1.53576375 0.28003008E-01 0.13700000E+05 0.24480187 17.72062419 1.53577281 0.27111941E-01 0.13750000E+05 0.23798395 17.75270335 1.53580537 0.26243885E-01 0.13800000E+05 0.23131679 17.78414437 1.53583992 0.25399054E-01 0.13850000E+05 0.22479963 17.81496406 1.53585345 0.24577271E-01 0.13900000E+05 0.21843146 17.84517838 1.53583788 0.23778017E-01 0.13950000E+05 0.21221110 17.87480231 1.53580334 0.23000596E-01 0.14000000E+05 0.20613717 17.90384989 1.53576939 0.22244333E-01 0.14050000E+05 0.20020815 17.93233432 1.53575381 0.21508701E-01 0.14100000E+05 0.19442238 17.96026807 1.53576270 0.20793354E-01 0.14150000E+05 0.18877811 17.98766306 1.53578666 0.20098089E-01 0.14200000E+05 0.18327346 18.01453086 1.53580861 0.19422776E-01 0.14250000E+05 0.17790651 18.04088281 1.53581750 0.18767270E-01 0.14300000E+05 0.17267524 18.06673018 1.53581309 0.18131337E-01 0.14350000E+05 0.16757757 18.09208414 1.53580074 0.17514595E-01 0.14400000E+05 0.16261139 18.11695586 1.53578690 0.16916522E-01 0.14450000E+05 0.15777450 18.14135640 1.53577647 0.16336502E-01 0.14500000E+05 0.15306468 18.16529667 1.53577003 0.15773923E-01 0.14550000E+05 0.14847967 18.18878730 1.53576581 0.15228263E-01 0.14600000E+05 0.14401714 18.21183861 1.53576564 0.14699145E-01 0.14650000E+05 0.13967476 18.23446049 1.53577430 0.14186332E-01 0.14700000E+05 0.13545015 18.25666240 1.53579112 0.13689653E-01 0.14750000E+05 0.13134092 18.27845339 1.53580779 0.13208903E-01 0.14800000E+05 0.12734467 18.29984211 1.53581439 0.12743773E-01 0.14850000E+05 0.12345899 18.32083686 1.53580439 0.12293822E-01 0.14900000E+05 0.11968147 18.34144566 1.53577853 0.11858537E-01 0.14950000E+05 0.11600972 18.36167620 1.53574889 0.11437408E-01 0.15000000E+05 0.11244134 18.38153590 1.53573429 0.11029992E-01 0.15050000E+05 0.10897396 18.40103180 1.53574535 0.10635938E-01 0.15100000E+05 0.10560522 18.42017056 1.53577602 0.10254962E-01 0.15150000E+05 0.10233277 18.43895840 1.53580952 0.98868075E-02 0.15200000E+05 0.09915428 18.45740111 1.53582743 0.95311967E-02 0.15250000E+05 0.09606746 18.47550406 1.53581779 0.91877975E-02 0.15300000E+05 0.09307005 18.49327232 1.53578425 0.88562152E-02 0.15350000E+05 0.09015980 18.51071074 1.53574700 0.85360168E-02 0.15400000E+05 0.08733452 18.52782408 1.53572778 0.82267760E-02 0.15450000E+05 0.08459205 18.54461711 1.53573497 0.79281177E-02 0.15500000E+05 0.08193028 18.56109468 1.53576304 0.76397359E-02 0.15550000E+05 0.07934714 18.57726177 1.53579739 0.73613776E-02 0.15600000E+05 0.07684059 18.59312347 1.53581904 0.70927998E-02 0.15650000E+05 0.07440863 18.60868495 1.53581564 0.68337246E-02 0.15700000E+05 0.07204931 18.62395139 1.53579158 0.65838227E-02 0.15750000E+05 0.06976071 18.63892792 1.53576218 0.63427339E-02 0.15800000E+05 0.06754094 18.65361961 1.53574081 0.61101074E-02 0.15850000E+05 0.06538815 18.66803139 1.53573572 0.58856373E-02 0.15900000E+05 0.06330054 18.68216811 1.53574972 0.56690680E-02 0.15950000E+05 0.06127634 18.69603449 1.53577529 0.54601791E-02 0.16000000E+05 0.05931380 18.70963518 1.53579759 0.52587654E-02 0.16050000E+05 0.05741122 18.72297473 1.53580673 0.50646239E-02 0.16100000E+05 0.05556695 18.73605761 1.53580160 0.48775417E-02 0.16150000E+05 0.05377935 18.74888820 1.53578403 0.46972820E-02 0.16200000E+05 0.05204685 18.76147075 1.53576003 0.45235825E-02 0.16250000E+05 0.05036787 18.77380940 1.53574211 0.43561792E-02 0.16300000E+05 0.04874092 18.78590817 1.53573986 0.41948415E-02 0.16350000E+05 0.04716450 18.79777096 1.53575223 0.40393890E-02 0.16400000E+05 0.04563717 18.80940160 1.53577315 0.38896723E-02 0.16450000E+05 0.04415752 18.82080390 1.53579574 0.37455365E-02 0.16500000E+05 0.04272419 18.83198163 1.53580899 0.36067961E-02 0.16550000E+05 0.04133582 18.84293860 1.53580298 0.34732371E-02 0.16600000E+05 0.03999111 18.85367861 1.53578035 0.33446391E-02 0.16650000E+05 0.03868880 18.86420547 1.53575346 0.32207953E-02 0.16700000E+05 0.03742764 18.87452294 1.53573391 0.31015235E-02 0.16750000E+05 0.03620642 18.88463477 1.53573119 0.29866666E-02 0.16800000E+05 0.03502396 18.89454462 1.53575090 0.28760881E-02 0.16850000E+05 0.03387912 18.90425609 1.53578492 0.27696592E-02 0.16900000E+05 0.03277077 18.91377268 1.53581263 0.26672419E-02 0.16950000E+05 0.03169782 18.92309783 1.53581831 0.25686750E-02 0.17000000E+05 0.03065921 18.93223489 1.53579970 0.24737785E-02 0.17050000E+05 0.02965391 18.94118711 1.53576412 0.23823764E-02 0.17100000E+05 0.02868091 18.94995770 1.53572852 0.22943246E-02 0.17150000E+05 0.02773922 18.95854976 1.53571577 0.22095239E-02 0.17200000E+05 0.02682790 18.96696634 1.53573620 0.21279041E-02 0.17250000E+05 0.02594602 18.97521041 1.53577674 0.20493881E-02 0.17300000E+05 0.02509267 18.98328490 1.53581408 0.19738604E-02 0.17350000E+05 0.02426698 18.99119268 1.53582937 0.19011652E-02 0.17400000E+05 0.02346809 18.99893661 1.53581222 0.18311393E-02 0.17450000E+05 0.02269518 19.00651946 1.53576882 0.17636554E-02 0.17500000E+05 0.02194743 19.01394402 1.53572576 0.16986408E-02 0.17550000E+05 0.02122408 19.02121303 1.53571087 0.16360595E-02 0.17600000E+05 0.02052434 19.02832921 1.53573057 0.15758711E-02 0.17650000E+05 0.01984750 19.03529526 1.53577169 0.15180006E-02 0.17700000E+05 0.01919282 19.04211384 1.53581340 0.14623367E-02 0.17750000E+05 0.01855961 19.04878753 1.53583203 0.14087557E-02 0.17800000E+05 0.01794719 19.05531887 1.53581386 0.13571492E-02 0.17850000E+05 0.01735490 19.06171028 1.53577100 0.13074402E-02 0.17900000E+05 0.01678211 19.06796416 1.53573193 0.12595804E-02 0.17950000E+05 0.01622818 19.07408283 1.53571691 0.12135340E-02 0.18000000E+05 0.01569253 19.08006857 1.53573072 0.11692587E-02 0.18050000E+05 0.01517456 19.08592363 1.53576719 0.11266945E-02 0.18100000E+05 0.01467372 19.09165020 1.53580680 0.10857644E-02 0.18150000E+05 0.01418944 19.09725043 1.53582434 0.10463844E-02 0.18200000E+05 0.01372119 19.10272642 1.53581112 0.10084744E-02 0.18250000E+05 0.01326846 19.10808022 1.53577955 0.97196639E-03 0.18300000E+05 0.01283074 19.11331389 1.53574657 0.93680718E-03 0.18350000E+05 0.01240755 19.11842942 1.53572646 0.90295696E-03 0.18400000E+05 0.01199842 19.12342883 1.53573143 0.87038273E-03 0.18450000E+05 0.01160289 19.12831408 1.53576048 0.83905006E-03 0.18500000E+05 0.01122051 19.13308709 1.53579442 0.80891660E-03 0.18550000E+05 0.01085086 19.13774978 1.53581413 0.77993110E-03 0.18600000E+05 0.01049352 19.14230399 1.53581357 0.75203770E-03 0.18650000E+05 0.01014808 19.14675156 1.53579341 0.72518200E-03 0.18700000E+05 0.00981416 19.15109432 1.53576080 0.69931502E-03 0.18750000E+05 0.00949138 19.15533404 1.53573464 0.67439477E-03 0.18800000E+05 0.00917936 19.15947248 1.53573214 0.65038598E-03 0.18850000E+05 0.00887776 19.16351137 1.53575192 0.62725996E-03 0.18900000E+05 0.00858623 19.16745241 1.53578147 0.60499287E-03 0.18950000E+05 0.00830443 19.17129725 1.53580889 0.58356217E-03 0.19000000E+05 0.00803205 19.17504754 1.53582024 0.56294157E-03 0.19050000E+05 0.00776877 19.17870487 1.53580504 0.54309802E-03 0.19100000E+05 0.00751429 19.18227082 1.53577199 0.52399260E-03 0.19150000E+05 0.00726832 19.18574695 1.53574301 0.50558486E-03 0.19200000E+05 0.00703056 19.18913474 1.53573219 0.48783778E-03 0.19250000E+05 0.00680076 19.19243564 1.53574308 0.47072140E-03 0.19300000E+05 0.00657864 19.19565106 1.53577369 0.45421394E-03 0.19350000E+05 0.00636395 19.19878231 1.53580924 0.43830131E-03 0.19400000E+05 0.00615643 19.20183067 1.53582570 0.42297457E-03 0.19450000E+05 0.00595585 19.20479738 1.53581306 0.40822537E-03 0.19500000E+05 0.00576198 19.20768363 1.53578259 0.39404033E-03 0.19550000E+05 0.00557458 19.21049058 1.53575048 0.38039673E-03 0.19600000E+05 0.00539345 19.21321938 1.53573131 0.36726269E-03 0.19650000E+05 0.00521836 19.21587117 1.53573898 0.35460254E-03 0.19700000E+05 0.00504913 19.21844704 1.53577240 0.34238482E-03 0.19750000E+05 0.00488554 19.22094810 1.53580922 0.33058834E-03 0.19800000E+05 0.00472742 19.22337543 1.53582710 0.31920312E-03 0.19850000E+05 0.00457457 19.22573007 1.53582047 0.30822596E-03 0.19900000E+05 0.00442683 19.22801305 1.53579360 0.29765399E-03 0.19950000E+05 0.00428401 19.23022538 1.53575753 0.28747963E-03 0.20000000E+05 0.00414595 19.23236805 1.53573413 0.27768912E-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 -0.001899 2.86670 2 0.1554312 -0.018829 2.32470 3 0.1597487 -0.023071 1.80606 4 0.1640662 -0.014603 1.30132 5 0.1683837 0.000151 0.80160 6 0.1727013 0.012164 0.30276 7 0.1770188 0.014949 -0.19159 8 0.1813363 0.008057 -0.67205 9 0.1856539 -0.003037 -1.13090 10 0.1899714 -0.010600 -1.56834 11 0.1942889 -0.009726 -1.99209 12 0.1986065 -0.001662 -2.41187 13 0.2029240 0.007054 -2.83243 14 0.2072415 0.009454 3.03373 15 0.2115591 0.003772 2.62992 16 0.2158766 -0.004774 2.24471 17 0.2201941 -0.008271 1.87398 18 0.2245117 -0.003433 1.50810 19 0.2288292 0.004830 1.14077 20 0.2331467 0.007901 0.77522 21 0.2374643 0.002423 0.42092 22 0.2417818 -0.005621 0.08272 23 0.2460993 -0.007115 -0.24467 24 0.2504169 -0.000291 -0.57074 25 0.2547344 0.006712 -0.89894 26 0.2590519 0.005330 -1.22250 27 0.2633695 -0.002678 -1.53285 28 0.2676870 -0.007020 -1.83061 29 0.2720045 -0.002003 -2.12475 30 0.2763221 0.005684 -2.42160 31 0.2806396 0.005623 -2.71679 32 0.2849571 -0.002068 -3.00099 33 0.2892746 -0.006607 3.01021 34 0.2935922 -0.001630 2.74189 35 0.2979097 0.005530 2.47041 36 0.3022272 0.004333 2.20013 37 0.3065448 -0.003383 1.94042 38 0.3108623 -0.005990 1.69161 39 0.3151798 0.000376 1.44443 40 0.3194974 0.005804 1.19343 41 0.3238149 0.001906 0.94525 42 0.3281324 -0.005020 0.70841 43 0.3324500 -0.003937 0.47979 44 0.3367675 0.003276 0.24934 45 0.3410850 0.004878 0.01569 46 0.3454026 -0.001577 -0.21135 47 0.3497201 -0.005271 -0.42696 48 0.3540376 -0.000148 -0.63944 49 0.3583552 0.004982 -0.85678 50 0.3626727 0.001409 -1.07320 51 0.3669902 -0.004641 -1.27866 52 0.3713078 -0.002767 -1.47640 53 0.3756253 0.003610 -1.67763 54 0.3799428 0.003272 -1.88224 55 0.3842604 -0.003064 -2.07840 56 0.3885779 -0.004077 -2.26372 57 0.3928954 0.001936 -2.44993 58 0.3972129 0.004026 -2.64218 59 0.4015305 -0.001537 -2.82907 60 0.4058480 -0.004444 -3.00344 61 0.4101655 0.000679 3.10701 62 0.4144831 0.004252 2.92659 63 0.4188006 -0.000410 2.74882 64 0.4231181 -0.004470 2.58483 65 0.4274357 -0.000258 2.42471 66 0.4317532 0.004050 2.25566 67 0.4360707 0.000121 2.08723 68 0.4403883 -0.004333 1.93389 69 0.4447058 -0.000565 1.78589 70 0.4490233 0.003956 1.62722 71 0.4533409 0.000284 1.46786 72 0.4576584 -0.004157 1.32567 73 0.4619759 -0.000457 1.18962 74 0.4662935 0.003826 1.04029 75 0.4706110 0.000100 0.88997 76 0.4749285 -0.003766 0.76003 77 0.4792461 0.000223 0.63576 78 0.4835636 0.003762 0.49415 79 0.4878811 -0.000304 0.35301 80 0.4921987 -0.003250 0.23717 81 0.4965162 0.000955 0.12463 82 0.5008337 0.003291 -0.01070 83 0.5051512 -0.000865 -0.14093 84 0.5094688 -0.002356 -0.23955 85 0.5137863 0.001919 -0.34113 86 0.5181038 0.003011 -0.47221 87 0.5224214 -0.000590 -0.58767 88 0.5267389 -0.000480 -0.66424 89 0.5310564 0.003405 -0.75601 90 0.5353740 0.003576 -0.88421 91 0.5396915 0.001107 -0.97880 92 0.5440090 0.002198 -1.03167 93 0.5483266 0.004929 -1.12605 ******************************************************************************** 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 0.9905730E+00 0.5066696E-02 0.4928978E+00 1 0.2759192E-04 0.8590559E-02 0.9088788E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.5127763E-04 0 31 2 -2 0.4094503E-06 0 37 2 -1 0.1570649E-04 0 44 2 0 0.1219638E-03 0 50 2 1 0.1163385E-03 0 56 2 2 0.8120468E-05 0 21 4 -4 0.9770383E-07 0 26 4 -3 0.9696110E-06 0 32 4 -2 0.7244376E-05 0 38 4 -1 0.4672220E-04 0 45 4 0 0.7729894E-04 0 51 4 1 0.6405002E-03 0 57 4 2 0.2737771E-03 0 62 4 3 0.1781756E-04 0 67 4 4 0.1911408E-05 0 13 6 -6 0.3761672E-08 0 17 6 -5 0.1853374E-07 0 22 6 -4 0.1516769E-06 0 27 6 -3 0.7855648E-06 0 33 6 -2 0.3615496E-05 0 39 6 -1 0.3094381E-04 0 46 6 0 0.1991309E-04 0 52 6 1 0.2175167E-02 0 58 6 2 0.4866464E-02 0 63 6 3 0.6468310E-03 0 68 6 4 0.1402006E-03 0 72 6 5 0.3260961E-04 0 76 6 6 0.5824390E-05 0 7 8 -8 0.8191210E-11 0 10 8 -7 0.1287868E-09 0 14 8 -6 0.1483144E-08 0 18 8 -5 0.4642423E-08 0 23 8 -4 0.3006912E-06 0 28 8 -3 0.7791098E-07 0 34 8 -2 0.2092969E-04 0 40 8 -1 0.1369197E-04 0 47 8 0 0.5762168E-02 0 53 8 1 0.1100764E-01 0 59 8 2 0.9300644E+00 0 64 8 3 0.2887666E-01 0 69 8 4 0.5323486E-02 0 73 8 5 0.1872896E-03 0 77 8 6 0.1315383E-04 0 80 8 7 0.4431471E-06 0 83 8 8 0.3381260E-07 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 0.3392676E-06 1 31 2 -2 0.1191128E-07 1 37 2 -1 0.5474755E-07 1 44 2 0 0.6706214E-06 1 50 2 1 0.4238980E-05 1 56 2 2 0.8925650E-05 1 21 4 -4 0.1340254E-10 1 26 4 -3 0.1234832E-09 1 32 4 -2 0.5372351E-09 1 38 4 -1 0.7744357E-08 1 45 4 0 0.1642268E-06 1 51 4 1 0.2173846E-05 1 57 4 2 0.1079330E-04 1 62 4 3 0.2008096E-06 1 67 4 4 0.1013746E-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 0.1557404E-14 1 0.5471013E-05 2 0.2810930E-04 3 0.1594640E-04 4 0.1663170E-05 5 0.3898176E-07 6 0.2694107E-07 7 0.1361855E-07 8 0.7017881E-08 9 0.1183014E-08 v, j, mj = 0 2 -2 0 0.1369163E-15 1 0.4143024E-08 2 0.1250268E-06 3 0.1959105E-06 4 0.5612070E-07 5 0.1609659E-07 6 0.6744699E-08 7 0.2281050E-08 8 0.1757739E-08 9 0.1369261E-08 v, j, mj = 0 2 -1 0 0.1917323E-09 1 0.3901652E-06 2 0.6428268E-05 3 0.7155064E-05 4 0.1608902E-05 5 0.9367836E-07 6 0.2437126E-07 7 0.3498475E-08 8 0.1589760E-08 9 0.7664389E-09 v, j, mj = 0 2 0 0 0.2158551E-14 1 0.1429915E-04 2 0.6852277E-04 3 0.3430984E-04 4 0.4509180E-05 5 0.2058211E-06 6 0.9039184E-07 7 0.1913329E-07 8 0.6930808E-08 9 0.6245490E-09 v, j, mj = 0 2 1 0 0.6174798E-17 1 0.5467360E-04 2 0.5189681E-04 3 0.8862489E-05 4 0.7978917E-06 5 0.4151332E-07 6 0.3814195E-07 7 0.2062309E-07 8 0.6428298E-08 9 0.9962072E-09 v, j, mj = 0 2 2 0 0.2109949E-05 1 0.3009754E-05 2 0.1091121E-05 3 0.1690886E-05 4 0.1242079E-06 5 0.5659010E-07 6 0.3292273E-07 7 0.3936229E-08 8 0.9076296E-09 9 0.1939199E-09 v, j, mj = 0 4 -4 0 0.2162609E-09 1 0.5388798E-09 2 0.2096884E-08 3 0.3532721E-07 4 0.4033157E-07 5 0.1291177E-07 6 0.2893613E-08 7 0.1102397E-08 8 0.1573583E-08 9 0.7116583E-09 v, j, mj = 0 4 -3 0 0.9224451E-16 1 0.3952793E-08 2 0.1353879E-06 3 0.4637009E-06 4 0.2849626E-06 5 0.6542349E-07 6 0.7540700E-08 7 0.5832576E-08 8 0.2574847E-08 9 0.2352354E-09 v, j, mj = 0 4 -2 0 0.6782591E-15 1 0.5222614E-07 2 0.1764217E-05 3 0.3795621E-05 4 0.1397759E-05 5 0.1908863E-06 6 0.3794067E-07 7 0.3583425E-08 8 0.1452644E-08 9 0.6892575E-09 v, j, mj = 0 4 -1 0 0.2710426E-08 1 0.1688863E-05 2 0.2015439E-04 3 0.2121617E-04 4 0.3433376E-05 5 0.1972961E-06 6 0.1756932E-07 7 0.6003629E-08 8 0.5289066E-08 9 0.5321378E-09 v, j, mj = 0 4 0 0 0.6020580E-14 1 0.1006732E-04 2 0.3836363E-04 3 0.2284313E-04 4 0.5763452E-05 5 0.2222496E-06 6 0.3331945E-07 7 0.3307743E-08 8 0.7291320E-09 9 0.1804160E-08 v, j, mj = 0 4 1 0 0.6451285E-17 1 0.3219349E-03 2 0.2551185E-03 3 0.5600816E-04 4 0.6802040E-05 5 0.4241373E-06 6 0.1845830E-06 7 0.2081022E-07 8 0.6606277E-08 9 0.4741849E-09 v, j, mj = 0 4 2 0 0.7343263E-04 1 0.1153539E-03 2 0.4878246E-04 3 0.3042311E-04 4 0.5492738E-05 5 0.2685301E-06 6 0.1444613E-07 7 0.5267458E-08 8 0.1921527E-08 9 0.2052699E-08 v, j, mj = 0 4 3 0 0.2436835E-16 1 0.8230347E-05 2 0.6075008E-05 3 0.1671822E-05 4 0.1625849E-05 5 0.1673629E-06 6 0.3763078E-07 7 0.5452017E-08 8 0.3440566E-08 9 0.6527473E-09 v, j, mj = 0 4 4 0 0.5690839E-15 1 0.4373505E-06 2 0.1107600E-05 3 0.3144901E-06 4 0.1578782E-07 5 0.2150728E-07 6 0.1122885E-07 7 0.2219412E-08 8 0.5201786E-09 9 0.7047457E-09 v, j, mj = 0 6 -6 0 0.2873297E-16 1 0.9651196E-11 2 0.4830291E-10 3 0.2624753E-09 4 0.4368885E-09 5 0.1727019E-09 6 0.1275350E-08 7 0.1307422E-08 8 0.2488798E-09 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.3724159E-16 1 0.5048158E-10 2 0.3552785E-09 3 0.4190570E-08 4 0.3107900E-08 5 0.4028686E-08 6 0.4053473E-08 7 0.2320648E-08 8 0.4267007E-09 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.1007023E-08 1 0.4520361E-08 2 0.1960152E-07 3 0.5266695E-07 4 0.3801050E-07 5 0.8338695E-08 6 0.1642445E-07 7 0.1090081E-07 8 0.2065746E-09 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.5264890E-16 1 0.2322036E-07 2 0.2174240E-06 3 0.3327656E-06 4 0.1198088E-06 5 0.3477978E-07 6 0.4745223E-07 7 0.9820822E-08 8 0.2931958E-09 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.8034308E-15 1 0.2501205E-06 2 0.1419641E-05 3 0.1035692E-05 4 0.6792459E-06 5 0.1632574E-06 6 0.5777662E-07 7 0.9569486E-08 8 0.1923263E-09 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.2062292E-07 1 0.9298336E-05 2 0.1783127E-04 3 0.3125826E-05 4 0.4826209E-06 5 0.9122469E-07 6 0.7814873E-07 7 0.1551666E-07 8 0.2446577E-09 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.1826430E-13 1 0.4192066E-05 2 0.9868081E-05 3 0.4953077E-05 4 0.7064319E-06 5 0.1795104E-06 6 0.9782666E-08 7 0.4082142E-08 8 0.5999177E-10 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.6611990E-15 1 0.1621825E-02 2 0.5264633E-03 3 0.2266789E-04 4 0.3721394E-05 5 0.4456308E-06 6 0.3045874E-07 7 0.1318476E-07 8 0.1872588E-09 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.1816098E-02 1 0.2263975E-02 2 0.6954551E-03 3 0.8915895E-04 4 0.1476053E-05 5 0.2904076E-06 6 0.8781143E-08 7 0.2120463E-08 8 0.5263397E-10 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.1848162E-15 1 0.2350695E-03 2 0.3316660E-03 3 0.7450282E-04 4 0.5458346E-05 5 0.5314836E-07 6 0.6651587E-07 7 0.1435024E-07 8 0.2757167E-09 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.8908160E-14 1 0.1379004E-04 2 0.7343794E-04 3 0.4707454E-04 4 0.5691380E-05 5 0.1925204E-06 6 0.8984799E-08 7 0.5044326E-08 8 0.1674476E-09 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.1881276E-09 1 0.2437809E-06 2 0.1086475E-04 3 0.1691106E-04 4 0.4341693E-05 5 0.2312219E-06 6 0.9498625E-08 7 0.7309482E-08 8 0.1140180E-09 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.8618268E-15 1 0.2154344E-07 2 0.8251999E-06 3 0.3297930E-05 4 0.1556112E-05 5 0.1112320E-06 6 0.1076505E-07 7 0.1581784E-08 8 0.2625362E-10 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.1413732E-18 1 0.3600329E-12 2 0.3156846E-12 3 0.2314838E-12 4 0.3143727E-11 5 0.4140281E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.6200284E-12 1 0.1040371E-11 2 0.9304206E-11 3 0.2353544E-11 4 0.1349890E-10 5 0.1019698E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.5733194E-18 1 0.1314218E-09 2 0.8768349E-10 3 0.5833891E-10 4 0.5717939E-09 5 0.6339060E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.3364917E-17 1 0.2170499E-08 2 0.5133972E-09 3 0.1944477E-09 4 0.2608134E-09 5 0.1503267E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.4326529E-07 1 0.5014480E-07 2 0.1141731E-06 3 0.1005124E-07 4 0.6177667E-07 5 0.2128007E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.1768485E-16 1 0.7925062E-08 2 0.2595751E-07 3 0.3621073E-07 4 0.5427896E-08 5 0.2389787E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.3896016E-16 1 0.4699408E-05 2 0.1336920E-04 3 0.1118865E-05 4 0.1622064E-05 5 0.1201500E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.2439915E-07 1 0.9803750E-05 2 0.2943257E-05 3 0.8281903E-06 4 0.8999788E-07 5 0.2374833E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.2268604E-15 1 0.4394063E-02 2 0.1311282E-02 3 0.5249016E-04 4 0.4202715E-05 5 0.1293495E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.5521970E-17 1 0.8688498E-02 2 0.2222749E-02 3 0.9456523E-04 4 0.1811817E-05 5 0.1808291E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.5157220E+00 1 0.3734109E+00 2 0.3962179E-01 3 0.1290093E-02 4 0.1914017E-04 5 0.5500673E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.9301998E-17 1 0.2145672E-01 2 0.7081831E-02 3 0.3330097E-03 4 0.5051862E-05 5 0.5255697E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.2990531E-15 1 0.2952291E-02 2 0.2184522E-02 3 0.1790842E-03 4 0.7516372E-05 5 0.7264933E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.3577646E-06 1 0.2611676E-04 2 0.1332228E-03 3 0.2626408E-04 4 0.1159986E-05 5 0.1681682E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.3310303E-16 1 0.2761262E-05 2 0.6418844E-05 3 0.2572192E-05 4 0.1144571E-05 5 0.2569638E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1051603E-17 1 0.7968912E-07 2 0.1328307E-06 3 0.9601384E-07 4 0.3304107E-07 5 0.1015724E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.2977926E-09 1 0.2582018E-08 2 0.9336261E-08 3 0.2418738E-08 4 0.1054774E-07 5 0.8630047E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.1342577E-15 1 0.7405734E-07 2 0.2178168E-06 3 0.3224212E-07 4 0.1044801E-07 5 0.4703346E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.5371644E-18 1 0.1260734E-08 2 0.1711907E-08 3 0.1962487E-08 4 0.6976155E-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 0.5722755E-10 1 0.1724040E-07 2 0.1528390E-07 3 0.1443901E-07 4 0.7727022E-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 0.7755797E-17 1 0.4601133E-06 2 0.1660085E-06 3 0.2855998E-07 4 0.1593955E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.1612695E-17 1 0.3837472E-05 2 0.3535302E-06 3 0.3942782E-07 4 0.8550255E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.2311515E-05 1 0.4826142E-05 2 0.1643992E-05 3 0.1410108E-06 4 0.2990144E-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 0.2532243E-12 1 0.5704421E-11 2 0.7444893E-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 -3 0 0.1224965E-18 1 0.1478780E-10 2 0.1086954E-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 -2 0 0.8283081E-19 1 0.1256353E-09 2 0.4115998E-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 -1 0 0.7641974E-10 1 0.1257388E-08 2 0.6410549E-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 0 0 0.8051667E-19 1 0.1299400E-06 2 0.3428681E-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 0.2088439E-18 1 0.2113331E-05 2 0.6051563E-07 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.5532325E-05 1 0.4904937E-05 2 0.3560401E-06 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.1365059E-18 1 0.1740595E-06 2 0.2675008E-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 0.4631894E-18 1 0.8296561E-08 2 0.1840895E-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 = 0.9906006 average vibrational energy (ev) = 0.000014 average rotational energy (ev) = 0.492887 average diffraction energy (ev) = 0.005067 the reaction probability = 0.9399415D-02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.41272524D+01 trans energy = 0.26428571D+00 trans energy in z = 0.26428571D+00 total momentum = 0.84480953D+01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.1003368E+01 0.5932661E-02 0.4885630E+00 1 0.2316058E-03 0.8950671E-02 0.1113267E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.2305154E-03 0 31 2 -2 0.3413221E-05 0 37 2 -1 0.8861838E-04 0 44 2 0 0.5787215E-03 0 50 2 1 0.4904349E-03 0 56 2 2 0.3695368E-04 0 21 4 -4 0.8252725E-06 0 26 4 -3 0.8054809E-05 0 32 4 -2 0.5566492E-04 0 38 4 -1 0.3173133E-03 0 45 4 0 0.4247184E-03 0 51 4 1 0.2242725E-02 0 57 4 2 0.9458538E-03 0 62 4 3 0.1069585E-03 0 67 4 4 0.1343033E-04 0 13 6 -6 0.7463445E-08 0 17 6 -5 0.8368767E-07 0 22 6 -4 0.1073447E-05 0 27 6 -3 0.6534514E-05 0 33 6 -2 0.2519170E-04 0 39 6 -1 0.1548072E-03 0 46 6 0 0.1220125E-03 0 52 6 1 0.7306322E-02 0 58 6 2 0.1106442E-01 0 63 6 3 0.2374753E-02 0 68 6 4 0.5929263E-03 0 72 6 5 0.1793586E-03 0 76 6 6 0.5059285E-04 0 7 8 -8 0.4727786E-10 0 10 8 -7 0.3267448E-09 0 14 8 -6 0.2959871E-08 0 18 8 -5 0.9358001E-08 0 23 8 -4 0.3730007E-06 0 28 8 -3 0.3081994E-06 0 34 8 -2 0.5413052E-04 0 40 8 -1 0.4599566E-04 0 47 8 0 0.1203823E-01 0 53 8 1 0.2491573E-01 0 59 8 2 0.8612907E+00 0 64 8 3 0.6386509E-01 0 69 8 4 0.1255713E-01 0 73 8 5 0.1109329E-02 0 77 8 6 0.6489196E-04 0 80 8 7 0.2139883E-05 0 83 8 8 0.9048268E-07 0 3 10 -10 0.1517401E-13 0 5 10 -9 0.8678663E-14 0 8 10 -8 0.5612743E-13 0 11 10 -7 0.4825455E-12 0 15 10 -6 0.5857007E-11 0 19 10 -5 0.1623002E-09 0 24 10 -4 0.1015145E-07 0 29 10 -3 0.2834755E-09 0 35 10 -2 0.1243604E-08 0 41 10 -1 0.1017326E-07 0 48 10 0 0.3113227E-07 0 54 10 1 0.2779016E-06 0 60 10 2 0.2195856E-06 0 65 10 3 0.5231018E-06 0 70 10 4 0.5185704E-07 0 74 10 5 0.1055039E-07 0 78 10 6 0.4597368E-08 0 81 10 7 0.2538707E-09 0 84 10 8 0.5659194E-08 0 86 10 9 0.5457108E-10 0 88 10 10 0.4874914E-11 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 0.8485487E-05 1 31 2 -2 0.2671165E-07 1 37 2 -1 0.3414767E-06 1 44 2 0 0.2155797E-05 1 50 2 1 0.2813126E-04 1 56 2 2 0.3036316E-04 1 21 4 -4 0.5835418E-09 1 26 4 -3 0.2970476E-08 1 32 4 -2 0.1180565E-07 1 38 4 -1 0.1082425E-06 1 45 4 0 0.1457090E-05 1 51 4 1 0.2388085E-04 1 57 4 2 0.1269036E-03 1 62 4 3 0.9455703E-05 1 67 4 4 0.2810733E-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 0.9667054E-14 1 0.2773981E-04 2 0.1399371E-03 3 0.5985261E-04 4 0.2837307E-05 5 0.1155009E-06 6 0.1713497E-07 7 0.1017411E-07 8 0.4212826E-08 9 0.1606815E-08 v, j, mj = 0 2 -2 0 0.3933313E-16 1 0.2010789E-07 2 0.1268660E-05 3 0.1618886E-05 4 0.4489660E-06 5 0.3314522E-07 6 0.1954695E-07 7 0.2464088E-08 8 0.8422241E-09 9 0.6020455E-09 v, j, mj = 0 2 -1 0 0.3329752E-08 1 0.3243624E-05 2 0.4178341E-04 3 0.3811253E-04 4 0.5359085E-05 5 0.5535949E-07 6 0.4501257E-07 7 0.1142849E-07 8 0.2622663E-08 9 0.1980680E-08 v, j, mj = 0 2 0 0 0.1279329E-13 1 0.7570141E-04 2 0.3543868E-03 3 0.1402425E-03 4 0.8177130E-05 5 0.1088440E-06 6 0.7918200E-07 7 0.2126033E-07 8 0.3291846E-08 9 0.1015313E-08 v, j, mj = 0 2 1 0 0.1290605E-16 1 0.2573180E-03 2 0.2057659E-03 3 0.2360273E-04 4 0.3607424E-05 5 0.9188577E-07 6 0.3160019E-07 7 0.1015152E-07 8 0.6165078E-08 9 0.9931149E-09 v, j, mj = 0 2 2 0 0.1007112E-04 1 0.1357032E-04 2 0.5789621E-05 3 0.6725371E-05 4 0.5901953E-06 5 0.1198418E-06 6 0.6085083E-07 7 0.2512882E-07 8 0.9081653E-09 9 0.3208204E-09 v, j, mj = 0 4 -4 0 0.3985191E-08 1 0.1066234E-08 2 0.2676313E-07 3 0.3326483E-06 4 0.3499635E-06 5 0.1008290E-06 6 0.5332632E-08 7 0.2903982E-08 8 0.1146458E-08 9 0.6340632E-09 v, j, mj = 0 4 -3 0 0.7952404E-15 1 0.2278964E-07 2 0.1221561E-05 3 0.4336817E-05 4 0.2094224E-05 5 0.3650765E-06 6 0.8134428E-08 7 0.3157608E-08 8 0.1626045E-08 9 0.1423360E-08 v, j, mj = 0 4 -2 0 0.1089298E-13 1 0.4165017E-06 2 0.1656799E-04 3 0.2973369E-04 4 0.8388661E-05 5 0.5032319E-06 6 0.4298938E-07 7 0.8772835E-08 8 0.2635376E-08 9 0.4534189E-09 v, j, mj = 0 4 -1 0 0.1366546E-07 1 0.1353148E-04 2 0.1523775E-03 3 0.1318772E-03 4 0.1888907E-04 5 0.5779161E-06 6 0.3562091E-07 7 0.6823890E-08 8 0.3132766E-08 9 0.8310902E-09 v, j, mj = 0 4 0 0 0.4627926E-13 1 0.5164484E-04 2 0.2170494E-03 3 0.1277762E-03 4 0.2745181E-04 5 0.6940542E-06 6 0.9655824E-07 7 0.2753944E-08 8 0.1771441E-08 9 0.1040400E-08 v, j, mj = 0 4 1 0 0.8431115E-15 1 0.1315961E-02 2 0.7725307E-03 3 0.1333837E-03 4 0.2005692E-04 5 0.5867534E-06 6 0.1798447E-06 7 0.1935264E-07 8 0.5296905E-08 9 0.1639743E-08 v, j, mj = 0 4 2 0 0.2910154E-03 1 0.3815572E-03 2 0.1515732E-03 3 0.1016333E-03 4 0.1844847E-04 5 0.1516518E-05 6 0.9591850E-07 7 0.9134516E-08 8 0.2622948E-08 9 0.2020429E-08 v, j, mj = 0 4 3 0 0.5074047E-16 1 0.5395864E-04 2 0.4112647E-04 3 0.5318013E-05 4 0.5542642E-05 5 0.8743852E-06 6 0.1318224E-06 7 0.3281312E-08 8 0.2471444E-08 9 0.7515180E-09 v, j, mj = 0 4 4 0 0.4884352E-14 1 0.2207948E-05 2 0.8231231E-05 3 0.2457015E-05 4 0.1790220E-06 5 0.2364435E-06 6 0.1118109E-06 7 0.5881798E-08 8 0.3567085E-09 9 0.6211242E-09 v, j, mj = 0 6 -6 0 0.4967918E-15 1 0.4224744E-10 2 0.1279606E-09 3 0.1132507E-08 4 0.2137105E-08 5 0.1398947E-08 6 0.3320554E-09 7 0.1106389E-08 8 0.1186232E-08 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.3431458E-15 1 0.3174640E-09 2 0.1803844E-08 3 0.2877337E-07 4 0.3170464E-07 5 0.8390129E-08 6 0.6072673E-08 7 0.2522635E-08 8 0.4102923E-08 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.2591027E-08 1 0.4385034E-08 2 0.1159762E-06 3 0.5816740E-06 4 0.3149603E-06 5 0.3028594E-07 6 0.1431595E-07 7 0.6516712E-08 8 0.2741923E-08 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.4998196E-16 1 0.3082864E-07 2 0.1864837E-05 3 0.3535693E-05 4 0.9521054E-06 5 0.7969443E-07 6 0.4836886E-07 7 0.1511593E-07 8 0.7869576E-08 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.1070477E-13 1 0.1491489E-05 2 0.1179140E-04 3 0.9566122E-05 4 0.2212537E-05 5 0.8318147E-07 6 0.4062183E-07 7 0.5340446E-08 8 0.1010675E-08 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.4685904E-07 1 0.3025369E-04 2 0.1111388E-03 3 0.1191315E-04 4 0.1265908E-05 5 0.1115430E-06 6 0.4031087E-07 7 0.3369815E-07 8 0.3295752E-08 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.2861505E-12 1 0.2617404E-04 2 0.6497068E-04 3 0.2789122E-04 4 0.2542566E-05 5 0.4053167E-06 6 0.2532126E-07 7 0.2497344E-08 8 0.8380245E-09 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.5549483E-14 1 0.6107343E-02 2 0.1089928E-02 3 0.9733374E-04 4 0.1069815E-04 5 0.9651964E-06 6 0.2257806E-07 7 0.2889827E-07 8 0.2493676E-08 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.4979356E-02 1 0.4181595E-02 2 0.1664973E-02 3 0.2349820E-03 4 0.2841794E-05 5 0.6599770E-06 6 0.1030429E-07 7 0.1232719E-08 8 0.1415687E-08 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.1743479E-14 1 0.8702518E-03 2 0.1157986E-02 3 0.3156921E-03 4 0.3021476E-04 5 0.5061564E-06 6 0.6673731E-07 7 0.3164358E-07 8 0.3799188E-08 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.8604897E-13 1 0.5512505E-04 2 0.3073406E-03 3 0.2046923E-03 4 0.2486303E-04 5 0.8778659E-06 6 0.2308460E-07 7 0.2505879E-08 8 0.1909638E-08 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.2703622E-08 1 0.1811124E-05 2 0.5414273E-04 3 0.9323557E-04 4 0.2814144E-04 5 0.1975279E-05 6 0.3926825E-07 7 0.5166529E-08 8 0.5313991E-08 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.8893259E-14 1 0.1543713E-06 2 0.5868786E-05 3 0.2503977E-04 4 0.1729857E-04 5 0.2174637E-05 6 0.5497218E-07 7 0.1350131E-08 8 0.4025637E-09 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.4509036E-17 1 0.2952205E-11 2 0.1466181E-11 3 0.2352810E-11 4 0.3476199E-11 5 0.2002920E-10 6 0.1700126E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1630408E-11 1 0.6983325E-11 2 0.4672775E-10 3 0.1694304E-10 4 0.2226087E-10 5 0.1921565E-09 6 0.4004288E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.6433163E-16 1 0.4577275E-09 2 0.3071001E-09 3 0.2965199E-09 4 0.5943365E-09 5 0.8411423E-09 6 0.4630446E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1529636E-15 1 0.1600346E-08 2 0.6575329E-09 3 0.1665019E-08 4 0.2625323E-09 5 0.4876740E-08 6 0.2958299E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.3264647E-07 1 0.3561985E-07 2 0.1837683E-06 3 0.4629609E-07 4 0.5828561E-07 5 0.1295998E-07 6 0.3424374E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.6378022E-15 1 0.7885728E-08 2 0.7917696E-07 3 0.1928657E-06 4 0.2025535E-07 5 0.7842217E-08 6 0.1734781E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.2128731E-14 1 0.1334744E-04 2 0.3633692E-04 3 0.2716889E-05 4 0.1651082E-05 5 0.7243313E-07 6 0.5745600E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.3683408E-07 1 0.2231021E-04 2 0.1972705E-04 3 0.3659777E-05 4 0.2326196E-06 5 0.2496392E-07 6 0.4204773E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.1940772E-13 1 0.9193145E-02 2 0.2695054E-02 3 0.1391244E-03 4 0.1065890E-04 5 0.5721113E-07 6 0.1898570E-06 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.2540167E-15 1 0.2035674E-01 2 0.4318952E-02 3 0.2312965E-03 4 0.8695818E-05 5 0.4883832E-07 6 0.6602640E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.4916898E+00 1 0.3280153E+00 2 0.3904101E-01 3 0.2485404E-02 4 0.5864197E-04 5 0.4995563E-06 6 0.6231867E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.3924030E-15 1 0.4730686E-01 2 0.1567958E-01 3 0.8507055E-03 4 0.2777483E-04 5 0.1644117E-06 6 0.9730874E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.2324849E-13 1 0.4685376E-02 2 0.6906662E-02 3 0.9312957E-03 4 0.3361943E-04 5 0.1734163E-06 6 0.3953392E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.5233079E-06 1 0.1148709E-03 2 0.7204931E-03 3 0.2607509E-03 4 0.1204658E-04 5 0.6206634E-06 6 0.2312329E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.3035632E-14 1 0.3590308E-05 2 0.3018260E-04 3 0.2822811E-04 4 0.2652201E-05 5 0.1132161E-06 6 0.1255214E-06 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.5707868E-16 1 0.1090426E-06 2 0.6565966E-06 3 0.1026118E-05 4 0.2205480E-06 5 0.1068415E-06 6 0.2073577E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.1627856E-10 1 0.8365993E-09 2 0.1856560E-07 3 0.3440859E-07 4 0.1425921E-07 5 0.9327188E-08 6 0.1306921E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.1068513E-13 1 0.4453652E-14 2 0.3522768E-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 -9 0 0.1022058E-20 1 0.8358157E-14 2 0.3205057E-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 -8 0 0.1464786E-18 1 0.5547694E-13 2 0.6503384E-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 0.3081156E-13 1 0.4510462E-12 2 0.6877609E-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 0.3319202E-19 1 0.5590763E-11 2 0.2662431E-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 -5 0 0.4185259E-19 1 0.1560960E-09 2 0.6204205E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.8619442E-08 1 0.1452072E-08 2 0.7993189E-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 0.6379983E-20 1 0.2808225E-09 2 0.2653050E-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 0.5827161E-19 1 0.1201389E-08 2 0.4221477E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.4721270E-09 1 0.9690238E-08 2 0.1089505E-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 0 0 0.2258635E-18 1 0.3105058E-07 2 0.8168596E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.7070749E-19 1 0.2759946E-06 2 0.1906973E-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 2 0 0.1372150E-06 1 0.8188353E-07 2 0.4870701E-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 3 0 0.1504970E-19 1 0.5219463E-06 2 0.1155541E-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 4 0 0.7768807E-18 1 0.5163462E-07 2 0.2224262E-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 0.6309591E-08 1 0.4225855E-08 2 0.1494013E-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 6 0 0.5322968E-19 1 0.4481782E-08 2 0.1155863E-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 0.7717531E-19 1 0.2516971E-09 2 0.2173689E-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 8 0 0.3930068E-08 1 0.1709340E-08 2 0.1978554E-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 9 0 0.2607943E-19 1 0.5293037E-10 2 0.1640708E-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 10 0 0.8993599E-19 1 0.4800384E-11 2 0.7453005E-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 0 0 0 0.4898363E-14 1 0.1390302E-05 2 0.6280248E-05 3 0.7670325E-06 4 0.3974771E-07 5 0.7285612E-08 6 0.8700985E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.2981361E-16 1 0.1655192E-08 2 0.1320458E-07 3 0.2521201E-08 4 0.2869883E-08 5 0.6460793E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.2343427E-10 1 0.5181595E-07 2 0.2529768E-06 3 0.2121436E-07 4 0.1329870E-07 5 0.2147496E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.1324896E-14 1 0.1692053E-05 2 0.3221630E-06 3 0.7779540E-07 4 0.4086379E-07 5 0.2292147E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.2704966E-16 1 0.2461101E-04 2 0.2632406E-05 3 0.8287140E-06 4 0.4691852E-07 5 0.1221671E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.8707471E-05 1 0.1894010E-04 2 0.1532202E-05 3 0.1061848E-05 4 0.1089829E-06 5 0.1255604E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.3265006E-11 1 0.1588715E-10 2 0.3984148E-10 3 0.3130281E-09 4 0.2115200E-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 -3 0 0.7172898E-18 1 0.5257505E-10 2 0.4556309E-09 3 0.1665580E-08 4 0.7966903E-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 0.2999748E-17 1 0.7500677E-09 2 0.3624792E-08 3 0.6158360E-08 4 0.1272435E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.3816617E-11 1 0.2417158E-07 2 0.7287279E-07 3 0.9769444E-08 4 0.1424879E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.6502444E-16 1 0.1116776E-05 2 0.2632436E-06 3 0.7466645E-07 4 0.2404225E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.2011547E-17 1 0.2190471E-04 2 0.1953423E-05 3 0.1967128E-07 4 0.3042585E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.4851291E-04 1 0.7150797E-04 2 0.6738491E-05 3 0.1422927E-06 4 0.1942362E-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 0.4012280E-19 1 0.6116111E-05 2 0.3281557E-05 3 0.5562077E-07 4 0.2414627E-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 0.2561790E-17 1 0.9603066E-07 2 0.1639322E-06 3 0.2040262E-07 4 0.7078334E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 1.0035992 average vibrational energy (ev) = 0.000118 average rotational energy (ev) = 0.488476 average diffraction energy (ev) = 0.005933 the reaction probability = -0.3599188D-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 0.9945546E+00 0.6812493E-02 0.4802631E+00 1 0.1385098E-02 0.1321374E-01 0.1187527E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.7291083E-03 0 31 2 -2 0.2212922E-04 0 37 2 -1 0.3748271E-03 0 44 2 0 0.1889590E-02 0 50 2 1 0.1246088E-02 0 56 2 2 0.9812414E-04 0 21 4 -4 0.4178206E-05 0 26 4 -3 0.4401199E-04 0 32 4 -2 0.2714020E-03 0 38 4 -1 0.1299575E-02 0 45 4 0 0.1426268E-02 0 51 4 1 0.5580832E-02 0 57 4 2 0.1987077E-02 0 62 4 3 0.3255618E-03 0 67 4 4 0.3806649E-04 0 13 6 -6 0.6536643E-07 0 17 6 -5 0.8231250E-06 0 22 6 -4 0.9488357E-05 0 27 6 -3 0.4873577E-04 0 33 6 -2 0.1553226E-03 0 39 6 -1 0.6749665E-03 0 46 6 0 0.5088472E-03 0 52 6 1 0.1711622E-01 0 58 6 2 0.1772831E-01 0 63 6 3 0.5505956E-02 0 68 6 4 0.1572662E-02 0 72 6 5 0.5510512E-03 0 76 6 6 0.1974861E-03 0 7 8 -8 0.2909899E-09 0 10 8 -7 0.9832954E-09 0 14 8 -6 0.6847809E-08 0 18 8 -5 0.3263241E-07 0 23 8 -4 0.8264708E-06 0 28 8 -3 0.1375399E-05 0 34 8 -2 0.1740604E-03 0 40 8 -1 0.1636301E-03 0 47 8 0 0.2265190E-01 0 53 8 1 0.4613331E-01 0 59 8 2 0.7200604E+00 0 64 8 3 0.1116806E+00 0 69 8 4 0.2828333E-01 0 73 8 5 0.5410556E-02 0 77 8 6 0.5383541E-03 0 80 8 7 0.3144014E-04 0 83 8 8 0.8393554E-06 0 3 10 -10 0.5026405E-12 0 5 10 -9 0.6515753E-12 0 8 10 -8 0.2046731E-11 0 11 10 -7 0.5892833E-11 0 15 10 -6 0.2726273E-09 0 19 10 -5 0.1259511E-08 0 24 10 -4 0.2870665E-07 0 29 10 -3 0.1959078E-08 0 35 10 -2 0.6368126E-07 0 41 10 -1 0.9592052E-07 0 48 10 0 0.2690572E-06 0 54 10 1 0.5567402E-06 0 60 10 2 0.1145619E-04 0 65 10 3 0.3604491E-05 0 70 10 4 0.5974017E-06 0 74 10 5 0.1375601E-06 0 78 10 6 0.2969539E-06 0 81 10 7 0.1016064E-07 0 84 10 8 0.1087368E-07 0 86 10 9 0.7086548E-09 0 88 10 10 0.3530952E-09 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.4833547E-04 1 31 2 -2 0.1177023E-05 1 37 2 -1 0.1155322E-04 1 44 2 0 0.3555323E-04 1 50 2 1 0.1564559E-03 1 56 2 2 0.6077460E-04 1 21 4 -4 0.3279227E-08 1 26 4 -3 0.1129560E-07 1 32 4 -2 0.8918232E-07 1 38 4 -1 0.5870434E-06 1 45 4 0 0.1436704E-04 1 51 4 1 0.1346795E-03 1 57 4 2 0.6815874E-03 1 62 4 3 0.2194444E-03 1 67 4 4 0.2013317E-04 1 13 6 -6 0.6532927E-12 1 17 6 -5 0.7001937E-11 1 22 6 -4 0.4654526E-09 1 27 6 -3 0.2339953E-10 1 33 6 -2 0.2385556E-08 1 39 6 -1 0.5017236E-08 1 46 6 0 0.6210259E-08 1 52 6 1 0.9174221E-08 1 58 6 2 0.3043225E-06 1 63 6 3 0.1230940E-07 1 68 6 4 0.5735556E-08 1 72 6 5 0.5376072E-09 1 76 6 6 0.3040551E-10 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 0.6495492E-13 1 0.8926378E-04 2 0.4706735E-03 3 0.1641681E-03 4 0.3932933E-05 5 0.9129723E-06 6 0.1233477E-06 7 0.2645819E-07 8 0.5627586E-08 9 0.1681046E-08 v, j, mj = 0 2 -2 0 0.5033541E-15 1 0.1734562E-06 2 0.8458557E-05 3 0.1126948E-04 4 0.2093974E-05 5 0.7082706E-07 6 0.5256278E-07 7 0.6503905E-08 8 0.2665299E-08 9 0.1198101E-08 v, j, mj = 0 2 -1 0 0.1635844E-07 1 0.1397782E-04 2 0.1929223E-03 3 0.1534841E-03 4 0.1371523E-04 5 0.6304902E-06 6 0.5473896E-07 7 0.2057434E-07 8 0.4293834E-08 9 0.1127637E-08 v, j, mj = 0 2 0 0 0.6318551E-13 1 0.2424398E-03 2 0.1200914E-02 3 0.4294891E-03 4 0.1605991E-04 5 0.5720208E-06 6 0.8931249E-07 7 0.2229864E-07 8 0.3447564E-08 9 0.9908231E-09 v, j, mj = 0 2 1 0 0.4362710E-15 1 0.7142090E-03 2 0.4898257E-03 3 0.3567115E-04 4 0.5740156E-05 5 0.5278569E-06 6 0.7796470E-07 7 0.3017429E-07 8 0.5104263E-08 9 0.8317109E-09 v, j, mj = 0 2 2 0 0.3038693E-04 1 0.3169467E-04 2 0.1897337E-04 3 0.1560153E-04 4 0.9075080E-06 5 0.2490802E-06 6 0.2095079E-06 7 0.9398793E-07 8 0.6877592E-08 9 0.6828826E-09 v, j, mj = 0 4 -4 0 0.2000133E-07 1 0.5527260E-08 2 0.1505872E-06 3 0.2003735E-05 4 0.1561128E-05 5 0.3960553E-06 6 0.3556661E-07 7 0.3607729E-08 8 0.1292395E-08 9 0.7058175E-09 v, j, mj = 0 4 -3 0 0.5492190E-14 1 0.1685624E-06 2 0.8070080E-05 3 0.2555074E-04 4 0.9227269E-05 5 0.9614364E-06 6 0.2503954E-07 7 0.6748547E-08 8 0.1275773E-08 9 0.8454177E-09 v, j, mj = 0 4 -2 0 0.8294669E-13 1 0.2275284E-05 2 0.9691519E-04 3 0.1406911E-03 4 0.3079289E-04 5 0.6521586E-06 6 0.6028749E-07 7 0.1085746E-07 8 0.3342965E-08 9 0.9480678E-09 v, j, mj = 0 4 -1 0 0.7822486E-07 1 0.6219131E-04 2 0.6647697E-03 3 0.5074146E-03 4 0.6436213E-04 5 0.6606335E-06 6 0.7654081E-07 7 0.1713787E-07 8 0.3052342E-08 9 0.1234915E-08 v, j, mj = 0 4 0 0 0.2483035E-12 1 0.1463849E-03 2 0.7126723E-03 3 0.4989217E-03 4 0.6735524E-04 5 0.7594211E-06 6 0.1625011E-06 7 0.9119948E-08 8 0.1430005E-08 9 0.1285665E-08 v, j, mj = 0 4 1 0 0.1190564E-13 1 0.3649008E-02 2 0.1738087E-02 3 0.1630777E-03 4 0.3008117E-04 5 0.3737533E-06 6 0.1762741E-06 7 0.2309699E-07 8 0.3555575E-08 9 0.1004969E-08 v, j, mj = 0 4 2 0 0.6877639E-03 1 0.7911946E-03 2 0.3215342E-03 3 0.1555634E-03 4 0.2570048E-04 5 0.4738579E-05 6 0.5578674E-06 7 0.2211111E-07 8 0.1175027E-08 9 0.1013398E-08 v, j, mj = 0 4 3 0 0.1526995E-14 1 0.1793638E-03 2 0.1243408E-03 3 0.1184411E-04 4 0.8194159E-05 5 0.1724084E-05 6 0.8599708E-07 7 0.5792985E-08 8 0.1845473E-08 9 0.1191924E-08 v, j, mj = 0 4 4 0 0.1259831E-13 1 0.6477442E-05 2 0.2214164E-04 3 0.6899671E-05 4 0.8180300E-06 5 0.1115763E-05 6 0.5536454E-06 7 0.5814090E-07 8 0.1764100E-08 9 0.3928977E-09 v, j, mj = 0 6 -6 0 0.2441842E-14 1 0.5356438E-10 2 0.9756201E-09 3 0.1320348E-07 4 0.3339029E-07 5 0.1275083E-07 6 0.1572900E-08 7 0.7468851E-09 8 0.2447369E-08 9 0.2254980E-09 v, j, mj = 0 6 -5 0 0.3091051E-14 1 0.9841727E-09 2 0.1545195E-07 3 0.3393838E-06 4 0.3875614E-06 5 0.6684271E-07 6 0.4834161E-08 7 0.3672928E-08 8 0.3903608E-08 9 0.4902930E-09 v, j, mj = 0 6 -4 0 0.1250412E-07 1 0.1883660E-07 2 0.9244133E-06 3 0.5717839E-05 4 0.2589492E-05 5 0.1824191E-06 6 0.2968805E-07 7 0.5858693E-08 8 0.6707231E-08 9 0.5995233E-09 v, j, mj = 0 6 -3 0 0.8765521E-15 1 0.1158725E-06 2 0.1394823E-04 3 0.2785765E-04 4 0.6406571E-05 5 0.3527603E-06 6 0.2436650E-07 7 0.2498820E-07 8 0.5130745E-08 9 0.1943323E-09 v, j, mj = 0 6 -2 0 0.7621208E-13 1 0.6157330E-05 2 0.7404787E-04 3 0.6382322E-04 4 0.1106858E-04 5 0.1969139E-06 6 0.2388786E-07 7 0.3813976E-08 8 0.9628324E-09 9 0.4227849E-10 v, j, mj = 0 6 -1 0 0.1358122E-06 1 0.9929567E-04 2 0.4751389E-03 3 0.8418855E-04 4 0.1568009E-04 5 0.4447431E-06 6 0.4528015E-07 7 0.3022699E-07 8 0.6535393E-08 9 0.6605710E-09 v, j, mj = 0 6 0 0 0.1941059E-11 1 0.1171170E-03 2 0.2243412E-03 3 0.1449695E-03 4 0.2147410E-04 5 0.8992011E-06 6 0.4249723E-07 7 0.1949634E-08 8 0.1403029E-08 9 0.1935085E-09 v, j, mj = 0 6 1 0 0.3322764E-13 1 0.1476999E-01 2 0.1867501E-02 3 0.4494729E-03 4 0.2769368E-04 5 0.1514794E-05 6 0.3565500E-07 7 0.9210379E-08 8 0.5589036E-08 9 0.2897002E-09 v, j, mj = 0 6 2 0 0.9952577E-02 1 0.4631082E-02 2 0.2758158E-02 3 0.3583596E-03 4 0.2517898E-04 5 0.2913990E-05 6 0.3564352E-07 7 0.3385632E-08 8 0.1443864E-08 9 0.1674896E-09 v, j, mj = 0 6 3 0 0.1113559E-13 1 0.2229308E-02 2 0.2369992E-02 3 0.8223062E-03 4 0.8273618E-04 5 0.1508297E-05 6 0.6457045E-07 7 0.3459050E-07 8 0.5996698E-08 9 0.2049804E-09 v, j, mj = 0 6 4 0 0.3436789E-12 1 0.1822579E-03 2 0.7778561E-03 3 0.5366973E-03 4 0.7250866E-04 5 0.3252638E-05 6 0.8081876E-07 7 0.4176195E-08 8 0.4537584E-08 9 0.2446060E-09 v, j, mj = 0 6 5 0 0.1272986E-07 1 0.8549597E-05 2 0.1678197E-03 3 0.2919755E-03 4 0.7635467E-04 5 0.6161429E-05 6 0.1688146E-06 7 0.5293663E-08 8 0.3284574E-08 9 0.2561070E-09 v, j, mj = 0 6 6 0 0.4182344E-13 1 0.7828283E-06 2 0.2437498E-04 3 0.9377539E-04 4 0.6594826E-04 5 0.1202159E-04 6 0.5683406E-06 7 0.1320410E-07 8 0.1381090E-08 9 0.1597401E-09 v, j, mj = 0 8 -8 0 0.1466968E-15 1 0.8030042E-11 2 0.3397376E-10 3 0.4286768E-10 4 0.3595003E-10 5 0.5068372E-10 6 0.6518264E-10 7 0.5430188E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.5086138E-11 1 0.2376130E-10 2 0.1712542E-09 3 0.8520350E-10 4 0.3718511E-10 5 0.2774345E-09 6 0.2385616E-09 7 0.1448090E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.1027252E-14 1 0.6726027E-09 2 0.1166723E-08 3 0.1920427E-08 4 0.1255221E-08 5 0.8235869E-09 6 0.8315706E-09 7 0.1776763E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1644688E-14 1 0.6991624E-08 2 0.2597141E-08 3 0.1103950E-07 4 0.3453129E-08 5 0.6740644E-08 6 0.1714397E-08 7 0.9598314E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1469130E-06 1 0.2804196E-07 2 0.3220918E-06 3 0.2684000E-06 4 0.4703283E-07 5 0.8929626E-08 6 0.4978929E-08 7 0.8263847E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.6494884E-14 1 0.1212487E-08 2 0.3182615E-06 3 0.9639924E-06 4 0.7496053E-07 5 0.1543822E-07 6 0.1468066E-08 7 0.6578756E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.3944379E-13 1 0.3919768E-04 2 0.1258877E-03 3 0.7531243E-05 4 0.1384210E-05 5 0.4754303E-07 6 0.1054765E-07 7 0.1480987E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.7121615E-07 1 0.5664155E-04 2 0.9801317E-04 3 0.8281441E-05 4 0.5849809E-06 5 0.3125332E-07 6 0.5975245E-08 7 0.5438992E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.5531944E-12 1 0.1853486E-01 2 0.3904018E-02 3 0.1896663E-03 4 0.2306273E-04 5 0.1992477E-06 6 0.1001896E-06 7 0.1560514E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.4284765E-14 1 0.4123761E-01 2 0.4364782E-02 3 0.5074037E-03 4 0.2318386E-04 5 0.3185437E-06 6 0.1116671E-07 7 0.1137266E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.4808279E+00 1 0.2081116E+00 2 0.2792578E-01 3 0.3102292E-02 4 0.9128389E-04 5 0.1460839E-05 6 0.5025071E-07 7 0.1505263E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.3699216E-14 1 0.8970775E-01 2 0.2049111E-01 3 0.1372983E-02 4 0.1074831E-03 5 0.1300710E-05 6 0.1638616E-07 7 0.6345705E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.5803728E-12 1 0.8098176E-02 2 0.1762764E-01 3 0.2450206E-02 4 0.1057023E-03 5 0.1588552E-05 6 0.1254752E-07 7 0.2490447E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.7473930E-06 1 0.5006780E-03 2 0.3228828E-02 3 0.1572094E-02 4 0.1062565E-03 5 0.1868728E-05 6 0.8284016E-07 7 0.2691114E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.8569255E-13 1 0.1816169E-05 2 0.2030950E-03 3 0.2937129E-03 4 0.3889375E-04 5 0.7545671E-06 6 0.8076835E-07 7 0.9402803E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1777039E-14 1 0.1641174E-06 2 0.6873116E-05 3 0.1864254E-04 4 0.5548526E-05 5 0.1509425E-06 6 0.5494449E-07 7 0.5956679E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.6219888E-08 1 0.9974950E-09 2 0.6431787E-07 3 0.5002225E-06 4 0.2337399E-06 5 0.8752139E-08 6 0.2069064E-07 7 0.4415000E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.8248000E-13 1 0.5746344E-13 2 0.1368700E-12 3 0.2258271E-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 0.6913631E-19 1 0.1296646E-12 2 0.1345987E-12 3 0.3873119E-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 -8 0 0.1570727E-18 1 0.1791371E-12 2 0.1334217E-11 3 0.5333767E-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 0.5126039E-14 1 0.2590419E-11 2 0.2388035E-11 3 0.9092523E-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 0.2242769E-19 1 0.1819053E-10 2 0.1444333E-09 3 0.1100034E-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 -5 0 0.1915773E-18 1 0.2421723E-10 2 0.8775960E-09 3 0.3576975E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.5129234E-09 1 0.5592745E-08 2 0.2121090E-07 3 0.1390085E-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 0.1446915E-17 1 0.4260824E-09 2 0.1252582E-08 3 0.2804141E-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 -2 0 0.1868983E-17 1 0.5153793E-07 2 0.1032008E-07 3 0.1823258E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.2330277E-08 1 0.1235970E-07 2 0.6712763E-07 3 0.1410291E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.4439884E-18 1 0.1835478E-06 2 0.6570674E-07 3 0.1980270E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.9953622E-18 1 0.1152931E-06 2 0.4006400E-06 3 0.4080712E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.5346240E-05 1 0.4960577E-05 2 0.1105798E-05 3 0.4357042E-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 3 0 0.7715524E-18 1 0.2561242E-05 2 0.8524364E-06 3 0.1908123E-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 0.2251933E-16 1 0.3159628E-06 2 0.2560905E-06 3 0.2534840E-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 5 0 0.8752217E-08 1 0.1797394E-07 2 0.6749622E-07 3 0.4333771E-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 6 0 0.1508135E-17 1 0.2669556E-06 2 0.2656268E-07 3 0.3435531E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.2307569E-18 1 0.6164035E-08 2 0.3135611E-08 3 0.8609982E-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 8 0 0.2039360E-08 1 0.1718597E-08 2 0.6354065E-08 3 0.7616559E-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 9 0 0.1582074E-18 1 0.1869857E-09 2 0.3393760E-09 3 0.1822931E-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 10 0 0.9343451E-18 1 0.1331670E-10 2 0.1574213E-09 3 0.1823572E-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 0 0 0 0.4296081E-13 1 0.1302655E-04 2 0.3144315E-04 3 0.3447874E-05 4 0.3739344E-06 5 0.3894014E-07 6 0.4941108E-08 7 0.8259887E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.3016343E-14 1 0.2975825E-07 2 0.6250228E-06 3 0.4640923E-06 4 0.5361408E-07 5 0.3556607E-08 6 0.9791337E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.5485793E-09 1 0.1558380E-05 2 0.7303717E-05 3 0.2571425E-05 4 0.1118213E-06 5 0.6186527E-08 6 0.1139635E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.3922154E-13 1 0.1008976E-05 2 0.2948993E-04 3 0.4943684E-05 4 0.7166671E-07 5 0.3712965E-07 6 0.1849906E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.3710982E-15 1 0.9737627E-04 2 0.4179825E-04 3 0.1625750E-04 4 0.9764308E-06 5 0.2624112E-07 6 0.2118592E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.1138175E-04 1 0.5941552E-05 2 0.2131404E-04 3 0.1898969E-04 4 0.3056843E-05 5 0.8885858E-07 6 0.1865937E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.1326321E-09 1 0.2902760E-09 2 0.5262522E-09 3 0.1890736E-09 4 0.2075982E-08 5 0.6501036E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.2592698E-16 1 0.9489943E-09 2 0.3288853E-08 3 0.2206814E-08 4 0.4087510E-08 5 0.7634294E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.1993213E-15 1 0.7918032E-08 2 0.5468667E-07 3 0.1445276E-07 4 0.1159408E-07 5 0.5307773E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.1170894E-08 1 0.1928838E-06 2 0.3564471E-06 3 0.3016971E-07 4 0.6102923E-08 5 0.2689210E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.4521921E-14 1 0.8787958E-05 2 0.5326514E-05 3 0.2189365E-06 4 0.3227278E-07 5 0.1354531E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.4048418E-16 1 0.1275592E-03 2 0.5689270E-05 3 0.1407652E-05 4 0.2037400E-07 5 0.3024254E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.2349523E-03 1 0.4096223E-03 2 0.3631929E-04 3 0.6391804E-06 4 0.5317003E-07 5 0.1068355E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.2703865E-17 1 0.1235192E-03 2 0.9086436E-04 3 0.5036832E-05 4 0.2318133E-07 5 0.8778174E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.2182223E-14 1 0.5242624E-05 2 0.1274004E-04 3 0.2124987E-05 4 0.2512524E-07 5 0.3868168E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.7993868E-19 1 0.5624135E-12 2 0.9087907E-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 0.8384557E-19 1 0.5765225E-11 2 0.1236712E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.1204951E-09 1 0.3384791E-09 2 0.6478386E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.3328841E-19 1 0.1884424E-10 2 0.4555287E-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 -2 0 0.3512441E-19 1 0.2341982E-08 2 0.4357395E-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 -1 0 0.3173283E-09 1 0.4680479E-08 2 0.1942943E-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 0.7266915E-19 1 0.6106590E-08 2 0.1036699E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.9589221E-19 1 0.7574010E-08 2 0.1600211E-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 6 2 0 0.2015307E-06 1 0.1013721E-06 2 0.1419778E-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 6 3 0 0.8366595E-19 1 0.1028849E-07 2 0.2020911E-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 6 4 0 0.1826555E-17 1 0.5515202E-08 2 0.2203542E-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 0.3210784E-09 1 0.8793698E-10 2 0.1285918E-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 0.7890937E-19 1 0.2160341E-10 2 0.8802102E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9959397 average vibrational energy (ev) = 0.000708 average rotational energy (ev) = 0.479760 average diffraction energy (ev) = 0.006821 the reaction probability = 0.4060332D-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 0.9910179E+00 0.8561956E-02 0.4681027E+00 1 0.5602696E-02 0.2187570E-01 0.1164457E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.1536004E-02 0 31 2 -2 0.8556489E-04 0 37 2 -1 0.1199768E-02 0 44 2 0 0.4602070E-02 0 50 2 1 0.2366975E-02 0 56 2 2 0.2034012E-03 0 21 4 -4 0.1070479E-04 0 26 4 -3 0.1419145E-03 0 32 4 -2 0.8896976E-03 0 38 4 -1 0.3646059E-02 0 45 4 0 0.3373268E-02 0 51 4 1 0.9904843E-02 0 57 4 2 0.3163063E-02 0 62 4 3 0.6793671E-03 0 67 4 4 0.1175382E-03 0 13 6 -6 0.7920922E-06 0 17 6 -5 0.6879741E-05 0 22 6 -4 0.6014960E-04 0 27 6 -3 0.2619117E-03 0 33 6 -2 0.7127654E-03 0 39 6 -1 0.2271310E-02 0 46 6 0 0.1554318E-02 0 52 6 1 0.3005293E-01 0 58 6 2 0.2378543E-01 0 63 6 3 0.9250878E-02 0 68 6 4 0.2869173E-02 0 72 6 5 0.9631369E-03 0 76 6 6 0.3732679E-03 0 7 8 -8 0.1597028E-08 0 10 8 -7 0.6596100E-08 0 14 8 -6 0.1697490E-07 0 18 8 -5 0.2558069E-06 0 23 8 -4 0.4182867E-05 0 28 8 -3 0.6872597E-05 0 34 8 -2 0.5436119E-03 0 40 8 -1 0.4972533E-03 0 47 8 0 0.3779779E-01 0 53 8 1 0.7000394E-01 0 59 8 2 0.5514181E+00 0 64 8 3 0.1516098E+00 0 69 8 4 0.5269871E-01 0 73 8 5 0.1796410E-01 0 77 8 6 0.3601590E-02 0 80 8 7 0.5040583E-03 0 83 8 8 0.3067642E-04 0 3 10 -10 0.4050609E-11 0 5 10 -9 0.5797692E-11 0 8 10 -8 0.1972633E-10 0 11 10 -7 0.2608751E-10 0 15 10 -6 0.1185037E-08 0 19 10 -5 0.1068457E-08 0 24 10 -4 0.3568397E-07 0 29 10 -3 0.9366033E-08 0 35 10 -2 0.5166902E-07 0 41 10 -1 0.3002634E-06 0 48 10 0 0.3450225E-05 0 54 10 1 0.4264901E-05 0 60 10 2 0.1965166E-03 0 65 10 3 0.4642005E-04 0 70 10 4 0.1950859E-05 0 74 10 5 0.3951959E-06 0 78 10 6 0.3357271E-06 0 81 10 7 0.3196251E-07 0 84 10 8 0.3645764E-07 0 86 10 9 0.7825812E-08 0 88 10 10 0.3164127E-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 0.1243588E-03 1 31 2 -2 0.6757122E-04 1 37 2 -1 0.8550726E-04 1 44 2 0 0.2192810E-03 1 50 2 1 0.7919614E-03 1 56 2 2 0.1566338E-03 1 21 4 -4 0.1617353E-07 1 26 4 -3 0.1890337E-06 1 32 4 -2 0.9153253E-06 1 38 4 -1 0.3589344E-05 1 45 4 0 0.8517179E-04 1 51 4 1 0.5056922E-03 1 57 4 2 0.8951759E-03 1 62 4 3 0.1275692E-02 1 67 4 4 0.1379794E-02 1 13 6 -6 0.1047264E-09 1 17 6 -5 0.1262316E-09 1 22 6 -4 0.6882259E-09 1 27 6 -3 0.6110784E-09 1 33 6 -2 0.3889425E-08 1 39 6 -1 0.9854829E-08 1 46 6 0 0.9962681E-07 1 52 6 1 0.8440460E-06 1 58 6 2 0.8492693E-05 1 63 6 3 0.1456840E-05 1 68 6 4 0.1902238E-06 1 72 6 5 0.3133334E-07 1 76 6 6 0.1614548E-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 0.1760013E-12 1 0.1659855E-03 2 0.9888558E-03 3 0.3546538E-03 4 0.2303848E-04 5 0.2319050E-05 6 0.8341657E-06 7 0.2607051E-06 8 0.5387296E-07 9 0.2497619E-08 v, j, mj = 0 2 -2 0 0.3932827E-13 1 0.7229394E-06 2 0.3770069E-04 3 0.4288351E-04 4 0.3716037E-05 5 0.2094440E-06 6 0.2324950E-06 7 0.8252854E-07 8 0.1544765E-07 9 0.1791886E-08 v, j, mj = 0 2 -1 0 0.5382232E-07 1 0.3891976E-04 2 0.6367560E-03 3 0.4820457E-03 4 0.3701177E-04 5 0.4637078E-05 6 0.2924966E-06 7 0.3776244E-07 8 0.1128283E-07 9 0.2014577E-08 v, j, mj = 0 2 0 0 0.5873091E-12 1 0.4702479E-03 2 0.2799135E-02 3 0.1258242E-02 4 0.7077806E-04 5 0.2960078E-05 6 0.5211192E-06 7 0.1500643E-06 8 0.3038935E-07 9 0.4326020E-08 v, j, mj = 0 2 1 0 0.1523560E-14 1 0.1394098E-02 2 0.9219966E-03 3 0.3939736E-04 4 0.8766492E-05 5 0.2151887E-05 6 0.3380468E-06 7 0.2091192E-06 8 0.1578980E-07 9 0.1947588E-08 v, j, mj = 0 2 2 0 0.6716397E-04 1 0.7749354E-04 2 0.2987553E-04 3 0.2613023E-04 4 0.1018199E-05 5 0.4889677E-06 6 0.6192362E-06 7 0.5020864E-06 8 0.1070475E-06 9 0.2372619E-08 v, j, mj = 0 4 -4 0 0.1235004E-06 1 0.4940391E-07 2 0.3548257E-06 3 0.5709930E-05 4 0.3585076E-05 5 0.7722308E-06 6 0.9784885E-07 7 0.1027382E-07 8 0.9834924E-09 9 0.7191963E-09 v, j, mj = 0 4 -3 0 0.4158199E-13 1 0.6964460E-06 2 0.3128393E-04 3 0.9023611E-04 4 0.1838265E-04 5 0.1176573E-05 6 0.1192999E-06 7 0.1566053E-07 8 0.2954275E-08 9 0.8913837E-09 v, j, mj = 0 4 -2 0 0.4882406E-12 1 0.9202644E-05 2 0.3632638E-03 3 0.4462998E-03 4 0.6986574E-04 5 0.8588247E-06 6 0.1841118E-06 7 0.1629704E-07 8 0.5086916E-08 9 0.1351044E-08 v, j, mj = 0 4 -1 0 0.2620911E-06 1 0.1719320E-03 2 0.1867133E-02 3 0.1443270E-02 4 0.1625852E-03 5 0.7429161E-06 6 0.9808257E-07 7 0.3010202E-07 8 0.5155540E-08 9 0.1372921E-08 v, j, mj = 0 4 0 0 0.8329194E-12 1 0.2141694E-03 2 0.1559859E-02 3 0.1503839E-02 4 0.9450829E-04 5 0.5766035E-06 6 0.2626428E-06 7 0.4510549E-07 8 0.6594288E-08 9 0.6696025E-09 v, j, mj = 0 4 1 0 0.6754219E-13 1 0.6344148E-02 2 0.3411660E-02 3 0.1092059E-03 4 0.3866506E-04 5 0.8237977E-06 6 0.2758725E-06 7 0.5895925E-07 8 0.3056038E-08 9 0.1273416E-08 v, j, mj = 0 4 2 0 0.1134682E-02 1 0.1287729E-02 2 0.5753515E-03 3 0.1295038E-03 4 0.2602345E-04 5 0.7308861E-05 6 0.2288621E-05 7 0.1646708E-06 8 0.9126867E-08 9 0.1051498E-08 v, j, mj = 0 4 3 0 0.7501352E-14 1 0.4069275E-03 2 0.2495661E-03 3 0.1187267E-04 4 0.8637087E-05 5 0.2063837E-05 6 0.2317709E-06 7 0.6410961E-07 8 0.2670340E-08 9 0.1420478E-08 v, j, mj = 0 4 4 0 0.2239160E-12 1 0.4044480E-04 2 0.6093781E-04 3 0.7052979E-05 4 0.3962790E-05 5 0.2952125E-05 6 0.1793720E-05 7 0.3710929E-06 8 0.2238772E-07 9 0.4658699E-09 v, j, mj = 0 6 -6 0 0.1917105E-13 1 0.4939282E-08 2 0.5316419E-08 3 0.1373600E-06 4 0.4572402E-06 5 0.1662780E-06 6 0.1804490E-07 7 0.7445121E-09 8 0.1475426E-08 9 0.6934621E-09 v, j, mj = 0 6 -5 0 0.2895118E-13 1 0.8241938E-08 2 0.1315252E-06 3 0.3051668E-05 4 0.3192683E-05 5 0.4613771E-06 6 0.2529488E-07 7 0.4645864E-08 8 0.1981736E-08 9 0.2322826E-08 v, j, mj = 0 6 -4 0 0.5895804E-07 1 0.1231241E-06 2 0.6135814E-05 3 0.3967861E-04 4 0.1334714E-04 5 0.7516213E-06 6 0.4308154E-07 7 0.4978511E-08 8 0.4547900E-08 9 0.1725947E-08 v, j, mj = 0 6 -3 0 0.1117333E-13 1 0.6563256E-06 2 0.8088526E-04 3 0.1533809E-03 4 0.2603001E-04 5 0.8947186E-06 6 0.3610321E-07 7 0.2181356E-07 8 0.5968734E-08 9 0.5717097E-09 v, j, mj = 0 6 -2 0 0.4057471E-12 1 0.2716764E-04 2 0.3305164E-03 3 0.2951207E-03 4 0.5906528E-04 5 0.8729276E-06 6 0.1732571E-07 7 0.2993802E-08 8 0.1606071E-08 9 0.4887752E-09 v, j, mj = 0 6 -1 0 0.2864275E-06 1 0.2727011E-03 2 0.1354622E-02 3 0.5518143E-03 4 0.9073436E-04 5 0.1084318E-05 6 0.3987240E-07 7 0.2176856E-07 8 0.3523522E-08 9 0.2295998E-08 v, j, mj = 0 6 0 0 0.7030856E-11 1 0.4146408E-03 2 0.4311205E-03 3 0.6302844E-03 4 0.7729649E-04 5 0.9221472E-06 6 0.4840920E-07 7 0.2998927E-08 8 0.1280300E-08 9 0.4494484E-09 v, j, mj = 0 6 1 0 0.1210826E-12 1 0.2344958E-01 2 0.5617783E-02 3 0.9289344E-03 4 0.5424464E-04 5 0.2308560E-05 6 0.7529037E-07 7 0.5422526E-08 8 0.2379700E-08 9 0.6498346E-09 v, j, mj = 0 6 2 0 0.1414989E-01 1 0.4982451E-02 2 0.3664108E-02 3 0.8470874E-03 4 0.1358571E-03 5 0.5868863E-05 6 0.1665065E-06 7 0.5594389E-08 8 0.2935745E-08 9 0.9303764E-09 v, j, mj = 0 6 3 0 0.4768305E-13 1 0.4553795E-02 2 0.3167800E-02 3 0.1447488E-02 4 0.8055126E-04 5 0.1114384E-05 6 0.1016779E-06 7 0.2193969E-07 8 0.4784592E-08 9 0.6376781E-09 v, j, mj = 0 6 4 0 0.3161316E-12 1 0.5282579E-03 2 0.1166938E-02 3 0.9698107E-03 4 0.1888879E-03 5 0.1466221E-04 6 0.5928425E-06 7 0.1585289E-07 8 0.7251618E-08 9 0.5357141E-09 v, j, mj = 0 6 5 0 0.5224476E-07 1 0.3760635E-04 2 0.3046118E-03 3 0.5062766E-03 4 0.1051822E-03 5 0.8995360E-05 6 0.3940787E-06 7 0.1232614E-07 8 0.3557895E-08 9 0.2329740E-08 v, j, mj = 0 6 6 0 0.1553047E-12 1 0.2216909E-05 2 0.5331650E-04 3 0.1837467E-03 4 0.1080908E-03 5 0.2409955E-04 6 0.1756129E-05 7 0.3945045E-07 8 0.1087864E-08 9 0.7189039E-09 v, j, mj = 0 8 -8 0 0.1608876E-14 1 0.4086218E-10 2 0.5244071E-09 3 0.5448656E-09 4 0.2244287E-09 5 0.6896468E-10 6 0.7571544E-10 7 0.1177832E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.2206199E-10 1 0.1340556E-09 2 0.2251734E-08 3 0.1853302E-08 4 0.9638644E-09 5 0.4602610E-09 6 0.4751607E-09 7 0.4356602E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.6200052E-14 1 0.1279206E-08 2 0.6190097E-08 3 0.3962769E-08 4 0.2492520E-08 5 0.1026452E-08 6 0.1359316E-08 7 0.6645335E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.6023904E-14 1 0.7074354E-07 2 0.8947188E-08 3 0.1045782E-06 4 0.5343848E-07 5 0.1356558E-07 6 0.3533470E-08 7 0.1000385E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.6019384E-06 1 0.2749699E-07 2 0.1180926E-05 3 0.2183202E-05 4 0.1701360E-06 5 0.1089668E-07 6 0.7665116E-08 7 0.6064750E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.2755492E-13 1 0.8427369E-07 2 0.1968817E-05 3 0.4572930E-05 4 0.2123845E-06 5 0.3134796E-07 6 0.2265422E-08 7 0.5790331E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.3432375E-12 1 0.1134524E-03 2 0.4162345E-03 3 0.1260976E-04 4 0.1247394E-05 5 0.4188560E-07 6 0.1838849E-07 7 0.7663995E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.1455441E-06 1 0.1466531E-03 2 0.3438919E-03 3 0.4268152E-05 4 0.2254885E-05 5 0.2651871E-07 6 0.1047180E-07 7 0.2741260E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.7137851E-11 1 0.3424741E-01 2 0.3223082E-02 3 0.2933397E-03 4 0.3356178E-04 5 0.3385033E-06 6 0.4785423E-07 7 0.1618180E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.3816046E-13 1 0.6713259E-01 2 0.1697651E-02 3 0.1144955E-02 4 0.2751060E-04 5 0.1207351E-05 6 0.1363976E-07 7 0.1149356E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.4496432E+00 1 0.7418361E-01 2 0.2533695E-01 3 0.2136322E-02 4 0.1149146E-03 5 0.2993673E-05 6 0.8822858E-07 7 0.3312158E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.1790068E-13 1 0.1357798E+00 2 0.1268454E-01 3 0.2888347E-02 4 0.2514202E-03 5 0.5586531E-05 6 0.2635935E-07 7 0.1111090E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.6637783E-11 1 0.1661492E-01 2 0.3296102E-01 3 0.2897844E-02 4 0.2175297E-03 5 0.7299329E-05 6 0.8461357E-07 7 0.3736567E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1330337E-05 1 0.1855204E-02 2 0.1054546E-01 3 0.5142801E-02 4 0.4089387E-03 5 0.1025582E-04 6 0.1014528E-06 7 0.4121568E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1151534E-11 1 0.3258535E-05 2 0.1255650E-02 3 0.1942814E-02 4 0.3861237E-03 5 0.1362476E-04 6 0.9900488E-07 7 0.2043076E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.2487868E-13 1 0.1318907E-05 2 0.7663965E-04 3 0.2956159E-03 4 0.1233551E-03 5 0.7077658E-05 6 0.3928989E-07 7 0.1177638E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.5311560E-07 1 0.1445509E-07 2 0.1714183E-05 3 0.1651586E-04 4 0.1150976E-04 5 0.8205727E-06 6 0.3670533E-07 7 0.1177185E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.4964040E-12 1 0.5677562E-12 2 0.1393625E-11 3 0.3975706E-12 4 0.1195253E-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 0.4838047E-18 1 0.3294178E-12 2 0.2221236E-11 3 0.1160098E-11 4 0.2086939E-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 -8 0 0.3019202E-17 1 0.2209041E-11 2 0.1737876E-11 3 0.7743402E-11 4 0.8036010E-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 0.3575299E-12 1 0.1743855E-11 2 0.4737063E-11 3 0.1448628E-10 4 0.4762774E-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 -6 0 0.1750915E-16 1 0.6400308E-09 2 0.2431634E-09 3 0.2784430E-09 4 0.2340025E-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 -5 0 0.1387406E-16 1 0.1785243E-09 2 0.5017499E-09 3 0.2883157E-09 4 0.9986728E-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 -4 0 0.1889825E-07 1 0.1034850E-07 2 0.5451750E-08 3 0.4925797E-09 4 0.4928902E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.6373605E-16 1 0.1712680E-08 2 0.5178128E-08 3 0.2131535E-08 4 0.3436900E-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 -2 0 0.4861065E-16 1 0.1283761E-07 2 0.2604386E-07 3 0.1192674E-07 4 0.8608075E-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 0.3504332E-08 1 0.1298227E-06 2 0.9598397E-07 3 0.6596584E-07 4 0.4986589E-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 0.5367800E-15 1 0.1888874E-05 2 0.1354986E-05 3 0.1924653E-06 4 0.1390004E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.2582068E-17 1 0.2767852E-05 2 0.1359991E-05 3 0.1190105E-06 4 0.1804720E-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 0.9860601E-04 1 0.9023571E-04 2 0.6908567E-05 3 0.7337231E-06 4 0.3259288E-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 0.2949828E-16 1 0.4086415E-04 2 0.5055831E-05 3 0.4231034E-06 4 0.7697068E-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 0.1715220E-14 1 0.1175524E-05 2 0.7161792E-06 3 0.3659380E-07 4 0.2256246E-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 5 0 0.7487163E-08 1 0.7169952E-07 2 0.1605020E-06 3 0.1447302E-06 4 0.1077709E-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 0.2792123E-15 1 0.3963163E-07 2 0.2401275E-06 3 0.3108956E-07 4 0.2487842E-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 0.3151822E-17 1 0.2641898E-08 2 0.1979462E-07 3 0.5117738E-08 4 0.4408256E-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 8 0 0.3355206E-09 1 0.1009121E-07 2 0.2130095E-07 3 0.3372583E-08 4 0.1357384E-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 9 0 0.2151309E-17 1 0.9835035E-09 2 0.2589361E-08 3 0.2780038E-08 4 0.1472909E-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 10 0 0.4929244E-17 1 0.1434819E-09 2 0.4189631E-09 3 0.1186406E-08 4 0.1415276E-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 0 0 0 0.7024560E-13 1 0.3228182E-04 2 0.8560127E-04 3 0.5454741E-05 4 0.7386616E-06 5 0.2693952E-06 6 0.1160813E-07 7 0.1333434E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.1505994E-13 1 0.8445836E-06 2 0.2713031E-04 3 0.3364006E-04 4 0.5806472E-05 5 0.1455102E-06 6 0.3953778E-08 7 0.3314182E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.1175034E-07 1 0.1163032E-04 2 0.5378631E-04 3 0.1910937E-04 4 0.9473175E-06 5 0.1924230E-07 6 0.2665892E-08 7 0.2784093E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.2791765E-12 1 0.4034265E-04 2 0.1607724E-03 3 0.1718049E-04 4 0.8428653E-06 5 0.1356382E-06 6 0.6132510E-08 7 0.8118755E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.1205415E-14 1 0.4166820E-03 2 0.2861493E-03 3 0.8391172E-04 4 0.5064590E-05 5 0.1378226E-06 6 0.1568375E-07 7 0.2409786E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.4309242E-04 1 0.4636180E-04 2 0.2274016E-04 3 0.3120105E-04 4 0.1237108E-04 5 0.8584761E-06 6 0.8517995E-08 7 0.2963010E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.3556714E-09 1 0.1781644E-08 2 0.3580042E-08 3 0.2729533E-08 4 0.5197155E-08 5 0.2451826E-08 6 0.7766005E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.3284632E-15 1 0.6682636E-08 2 0.8516012E-07 3 0.5758283E-07 4 0.1995895E-07 5 0.1963801E-07 6 0.1116847E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.2523075E-14 1 0.4974762E-07 2 0.6289144E-06 3 0.1758138E-06 4 0.5379037E-07 5 0.7058580E-08 6 0.5243869E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.6792711E-08 1 0.1483025E-05 2 0.1267388E-05 3 0.6754528E-06 4 0.1467430E-06 5 0.9909686E-08 6 0.3355709E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.7334752E-13 1 0.3451407E-04 2 0.4629043E-04 3 0.4226523E-05 4 0.1092531E-06 5 0.3136626E-07 6 0.1502271E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.4890618E-16 1 0.4822763E-03 2 0.5249637E-05 3 0.1748796E-04 4 0.6679631E-06 5 0.1022612E-07 6 0.1697143E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.2942136E-03 1 0.5460180E-03 2 0.4402647E-04 3 0.9741794E-05 4 0.1164470E-05 5 0.1148233E-07 6 0.1082505E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.2088994E-15 1 0.5544164E-03 2 0.6515818E-03 3 0.6895385E-04 4 0.7039797E-06 5 0.3621623E-07 6 0.1158110E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.2216114E-13 1 0.2053098E-03 2 0.8721331E-03 3 0.2912994E-03 4 0.1098155E-04 5 0.7057697E-07 6 0.6581900E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.1739036E-18 1 0.2290025E-10 2 0.5915724E-10 3 0.2266888E-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 = 1 6 -5 0 0.1993134E-18 1 0.1757717E-10 2 0.3069968E-10 3 0.7795471E-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 = 1 6 -4 0 0.4630373E-10 1 0.1404176E-09 2 0.3993389E-09 3 0.1021656E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.1214043E-17 1 0.3144076E-09 2 0.2091427E-09 3 0.8752809E-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 = 1 6 -2 0 0.1200004E-16 1 0.5516756E-09 2 0.2832604E-08 3 0.5051459E-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 0.7856163E-09 1 0.4788513E-08 2 0.2527854E-08 3 0.1752846E-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 0 0 0.9579834E-16 1 0.3921317E-07 2 0.5604398E-07 3 0.4369658E-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 1 0 0.1112079E-17 1 0.6918969E-06 2 0.1467424E-06 3 0.5406676E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.4358437E-05 1 0.4025344E-05 2 0.6675689E-07 3 0.4215484E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.1640701E-18 1 0.1049002E-05 2 0.3812154E-06 3 0.2662308E-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 4 0 0.2778572E-16 1 0.4790135E-07 2 0.1315354E-06 3 0.1078704E-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 0.2218653E-09 1 0.1623241E-08 2 0.1255285E-07 3 0.1693539E-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 0.9135726E-18 1 0.3509057E-08 2 0.4838421E-08 3 0.7798001E-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 sum of the probabilities = 0.9966206 average vibrational energy (ev) = 0.002864 average rotational energy (ev) = 0.466126 average diffraction energy (ev) = 0.008637 the reaction probability = 0.3379367D-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 0.9893550E+00 0.1279243E-01 0.4529077E+00 1 0.1019955E-01 0.2632719E-01 0.1171258E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.2921159E-02 0 31 2 -2 0.2612090E-03 0 37 2 -1 0.2637789E-02 0 44 2 0 0.8525813E-02 0 50 2 1 0.3956302E-02 0 56 2 2 0.3006987E-03 0 21 4 -4 0.1875789E-04 0 26 4 -3 0.3188440E-03 0 32 4 -2 0.2074206E-02 0 38 4 -1 0.7623072E-02 0 45 4 0 0.5998306E-02 0 51 4 1 0.1478795E-01 0 57 4 2 0.4581134E-02 0 62 4 3 0.1005863E-02 0 67 4 4 0.2944943E-03 0 13 6 -6 0.6831224E-05 0 17 6 -5 0.4195891E-04 0 22 6 -4 0.2787710E-03 0 27 6 -3 0.9906314E-03 0 33 6 -2 0.2391549E-02 0 39 6 -1 0.6092256E-02 0 46 6 0 0.3492763E-02 0 52 6 1 0.4127336E-01 0 58 6 2 0.2876058E-01 0 63 6 3 0.1265676E-01 0 68 6 4 0.5391363E-02 0 72 6 5 0.1375723E-02 0 76 6 6 0.4308418E-03 0 7 8 -8 0.1723792E-07 0 10 8 -7 0.1817342E-07 0 14 8 -6 0.6411606E-07 0 18 8 -5 0.2364907E-05 0 23 8 -4 0.2632495E-04 0 28 8 -3 0.3503143E-04 0 34 8 -2 0.1492009E-02 0 40 8 -1 0.1273374E-02 0 47 8 0 0.5571421E-01 0 53 8 1 0.8973185E-01 0 59 8 2 0.3803120E+00 0 64 8 3 0.1653323E+00 0 69 8 4 0.7616884E-01 0 73 8 5 0.4094260E-01 0 77 8 6 0.1352676E-01 0 80 8 7 0.3824804E-02 0 83 8 8 0.6987235E-03 0 3 10 -10 0.2842103E-10 0 5 10 -9 0.4965772E-10 0 8 10 -8 0.8677619E-10 0 11 10 -7 0.1902912E-09 0 15 10 -6 0.3218085E-08 0 19 10 -5 0.4653440E-08 0 24 10 -4 0.6163710E-07 0 29 10 -3 0.4265327E-07 0 35 10 -2 0.4454220E-06 0 41 10 -1 0.1581960E-05 0 48 10 0 0.4125451E-04 0 54 10 1 0.5700088E-04 0 60 10 2 0.1250849E-02 0 65 10 3 0.3997376E-03 0 70 10 4 0.2888439E-04 0 74 10 5 0.3299842E-05 0 78 10 6 0.1298828E-05 0 81 10 7 0.1663885E-06 0 84 10 8 0.7821170E-07 0 86 10 9 0.6414870E-07 0 88 10 10 0.1340881E-07 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 0.2697241E-03 1 31 2 -2 0.2316672E-03 1 37 2 -1 0.6227737E-03 1 44 2 0 0.6351737E-03 1 50 2 1 0.8390391E-03 1 56 2 2 0.1627023E-03 1 21 4 -4 0.3495993E-06 1 26 4 -3 0.5477848E-05 1 32 4 -2 0.4447284E-04 1 38 4 -1 0.3640314E-04 1 45 4 0 0.2975721E-03 1 51 4 1 0.1713361E-02 1 57 4 2 0.9622122E-03 1 62 4 3 0.1771712E-02 1 67 4 4 0.2443822E-02 1 13 6 -6 0.6401943E-09 1 17 6 -5 0.8321190E-09 1 22 6 -4 0.1050685E-08 1 27 6 -3 0.9027801E-08 1 33 6 -2 0.3803693E-07 1 39 6 -1 0.3406610E-07 1 46 6 0 0.2271361E-05 1 52 6 1 0.2401978E-04 1 58 6 2 0.7924813E-04 1 63 6 3 0.5138144E-04 1 68 6 4 0.5852554E-05 1 72 6 5 0.1830769E-06 1 76 6 6 0.4385326E-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 0.1262791E-12 1 0.2638289E-03 2 0.1611917E-02 3 0.8960326E-03 4 0.1385639E-03 5 0.6980287E-05 6 0.1949200E-05 7 0.1407876E-05 8 0.4327057E-06 9 0.4705971E-07 v, j, mj = 0 2 -2 0 0.5559223E-12 1 0.2775345E-05 2 0.1094009E-03 3 0.1362533E-03 4 0.9961516E-05 5 0.1017245E-05 6 0.8463374E-06 7 0.7333154E-06 8 0.2061028E-06 9 0.1503554E-07 v, j, mj = 0 2 -1 0 0.8497024E-07 1 0.5268877E-04 2 0.1343745E-02 3 0.1099808E-02 4 0.1272860E-03 5 0.1109928E-04 6 0.2685097E-05 7 0.3328881E-06 8 0.5446085E-07 9 0.3966528E-08 v, j, mj = 0 2 0 0 0.1467027E-11 1 0.5126768E-03 2 0.4330130E-02 3 0.3330128E-02 4 0.3354468E-03 5 0.1309218E-04 6 0.3205274E-05 7 0.8555574E-06 8 0.2528149E-06 9 0.2579933E-07 v, j, mj = 0 2 1 0 0.1325837E-12 1 0.2123640E-02 2 0.1651641E-02 3 0.1254880E-03 4 0.4712759E-04 5 0.5241587E-05 6 0.2026401E-05 7 0.9354819E-06 8 0.1928859E-06 9 0.8919109E-08 v, j, mj = 0 2 2 0 0.1205233E-03 1 0.1191468E-03 2 0.4066321E-04 3 0.1002421E-04 4 0.1852569E-05 5 0.3059506E-05 6 0.2105510E-05 7 0.2358427E-05 8 0.9076381E-06 9 0.5755412E-07 v, j, mj = 0 4 -4 0 0.2821677E-06 1 0.2621301E-06 2 0.6345939E-06 3 0.1184154E-04 4 0.3830007E-05 5 0.1081214E-05 6 0.6324294E-06 7 0.1751130E-06 8 0.1771271E-07 9 0.9792672E-09 v, j, mj = 0 4 -3 0 0.7479339E-13 1 0.1665697E-05 2 0.9269572E-04 3 0.1985678E-03 4 0.2232452E-04 5 0.2301211E-05 6 0.1156134E-05 7 0.1259415E-06 8 0.5343940E-08 9 0.1585268E-08 v, j, mj = 0 4 -2 0 0.2103506E-11 1 0.3310298E-04 2 0.8896313E-03 3 0.1023372E-02 4 0.1167389E-03 5 0.1017039E-04 6 0.1058110E-05 7 0.1192547E-06 8 0.1155609E-07 9 0.1521762E-08 v, j, mj = 0 4 -1 0 0.4828685E-06 1 0.2712143E-03 2 0.3503460E-02 3 0.3436549E-02 4 0.3932284E-03 5 0.1782677E-04 6 0.2409795E-06 7 0.5688464E-07 8 0.1085851E-07 9 0.2486022E-08 v, j, mj = 0 4 0 0 0.1995720E-11 1 0.1028237E-03 2 0.2116260E-02 3 0.3621286E-02 4 0.1500322E-03 5 0.7194149E-05 6 0.4187138E-06 7 0.2530738E-06 8 0.3592958E-07 9 0.2155173E-08 v, j, mj = 0 4 1 0 0.3347804E-12 1 0.7169153E-02 2 0.7128384E-02 3 0.3431832E-03 4 0.1424139E-03 5 0.3446679E-05 6 0.1098774E-05 7 0.2509364E-06 8 0.1969054E-07 9 0.6674880E-09 v, j, mj = 0 4 2 0 0.1482953E-02 1 0.2124166E-02 2 0.7649192E-03 3 0.1222340E-03 4 0.6744988E-04 5 0.1239425E-04 6 0.5819231E-05 7 0.1112786E-05 8 0.8391942E-07 9 0.1597327E-08 v, j, mj = 0 4 3 0 0.7842361E-14 1 0.7681013E-03 2 0.2047016E-03 3 0.1716987E-04 4 0.6935962E-05 5 0.6037220E-05 6 0.2228241E-05 7 0.6328039E-06 8 0.5424549E-07 9 0.1381744E-08 v, j, mj = 0 4 4 0 0.4888064E-12 1 0.7101707E-04 2 0.1372090E-03 3 0.5951225E-04 4 0.1035803E-04 5 0.9541586E-05 6 0.5033299E-05 7 0.1641498E-05 8 0.1784515E-06 9 0.3207777E-08 v, j, mj = 0 6 -6 0 0.1477411E-12 1 0.1135093E-06 2 0.3156466E-07 3 0.1338474E-05 4 0.3958607E-05 5 0.1221337E-05 6 0.1584082E-06 7 0.6317046E-08 8 0.8273214E-09 9 0.2180618E-08 v, j, mj = 0 6 -5 0 0.1438628E-12 1 0.1591991E-06 2 0.1046870E-05 3 0.2033653E-04 4 0.1876259E-04 5 0.1538870E-05 6 0.9873736E-07 7 0.1223292E-07 8 0.2896164E-08 9 0.9784088E-09 v, j, mj = 0 6 -4 0 0.2591782E-06 1 0.8145119E-06 2 0.3100417E-04 3 0.2005403E-03 4 0.4519415E-04 5 0.9243858E-06 6 0.2361377E-07 7 0.4681208E-08 8 0.3207117E-08 9 0.2841142E-08 v, j, mj = 0 6 -3 0 0.6623177E-13 1 0.3644130E-05 2 0.3324098E-03 3 0.5859625E-03 4 0.6651866E-04 5 0.2019911E-05 6 0.5234251E-07 7 0.1842085E-07 8 0.5143193E-08 9 0.5517573E-09 v, j, mj = 0 6 -2 0 0.2248710E-11 1 0.9461139E-04 2 0.1014914E-02 3 0.1024223E-02 4 0.2554098E-03 5 0.2367035E-05 6 0.1547291E-07 7 0.6535831E-08 8 0.1437745E-08 9 0.9308895E-09 v, j, mj = 0 6 -1 0 0.5627668E-06 1 0.5837981E-03 2 0.2636348E-02 3 0.2492718E-02 4 0.3773371E-03 5 0.1412241E-05 6 0.6484204E-07 7 0.1046018E-07 8 0.3143745E-08 9 0.1877194E-08 v, j, mj = 0 6 0 0 0.1880118E-10 1 0.9232385E-03 2 0.4111619E-03 3 0.1956222E-02 4 0.1982324E-03 5 0.3825907E-05 6 0.6789246E-07 7 0.1098395E-07 8 0.1950057E-08 9 0.7733422E-09 v, j, mj = 0 6 1 0 0.2251236E-12 1 0.2299961E-01 2 0.1726997E-01 3 0.7581031E-03 4 0.2416381E-03 5 0.3822713E-05 6 0.2056531E-06 7 0.1162737E-07 8 0.2218489E-08 9 0.5184487E-09 v, j, mj = 0 6 2 0 0.1208920E-01 1 0.8881056E-02 2 0.3869037E-02 3 0.3702491E-02 4 0.2128668E-03 5 0.5240969E-05 6 0.6558570E-06 7 0.3221060E-07 8 0.1959298E-08 9 0.2006190E-08 v, j, mj = 0 6 3 0 0.1348632E-12 1 0.7145800E-02 2 0.3389137E-02 3 0.2035135E-02 4 0.7456672E-04 5 0.1098530E-04 6 0.1073525E-05 7 0.5543288E-07 8 0.7450869E-08 9 0.1158539E-08 v, j, mj = 0 6 4 0 0.2774176E-12 1 0.1740967E-02 2 0.1691030E-02 3 0.1642114E-02 4 0.2802748E-03 5 0.3357687E-04 6 0.3266448E-05 7 0.1269160E-06 8 0.6187859E-08 9 0.1309991E-08 v, j, mj = 0 6 5 0 0.1937653E-06 1 0.1165806E-03 2 0.4923694E-03 3 0.6384092E-03 4 0.1040713E-03 5 0.2104961E-04 6 0.2953666E-05 7 0.9085943E-07 8 0.3637883E-08 9 0.6984094E-09 v, j, mj = 0 6 6 0 0.1595482E-12 1 0.3555888E-05 2 0.8364143E-04 3 0.2446219E-03 4 0.7002237E-04 5 0.2412446E-04 6 0.4712146E-05 7 0.1599472E-06 8 0.2557393E-08 9 0.1159321E-08 v, j, mj = 0 8 -8 0 0.1568924E-13 1 0.4751292E-09 2 0.6742422E-08 3 0.4950479E-08 4 0.3993598E-08 5 0.5816539E-09 6 0.1633597E-09 7 0.2121372E-09 8 0.1191274E-09 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.3571847E-10 1 0.2021403E-08 2 0.9388465E-08 3 0.2180069E-08 4 0.1665270E-08 5 0.9122829E-09 6 0.5593914E-09 7 0.8693804E-09 8 0.5414415E-09 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.4340809E-13 1 0.6663192E-08 2 0.1338932E-07 3 0.1098566E-07 4 0.2571640E-07 5 0.4187421E-08 6 0.2050531E-08 7 0.1024253E-08 8 0.9923982E-10 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.8133413E-14 1 0.2618385E-06 2 0.4857345E-07 3 0.1333216E-05 4 0.6642537E-06 5 0.4943416E-07 6 0.5647017E-08 7 0.1836833E-08 8 0.1075900E-09 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1295722E-05 1 0.6589076E-07 2 0.7513490E-05 3 0.1593872E-04 4 0.1464238E-05 5 0.3750813E-07 6 0.8517029E-08 7 0.7984950E-09 8 0.7128765E-10 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.7802437E-13 1 0.9105797E-06 2 0.1223602E-04 3 0.2064055E-04 4 0.1154340E-05 5 0.8198483E-07 6 0.6542361E-08 7 0.1036032E-08 8 0.3690161E-09 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1947815E-11 1 0.3033602E-03 2 0.1152907E-02 3 0.2948405E-04 4 0.6191166E-05 5 0.3781711E-07 6 0.2240234E-07 7 0.6288872E-08 8 0.3053967E-09 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.2922951E-06 1 0.3482936E-03 2 0.8889169E-03 3 0.2759448E-04 4 0.8189042E-05 5 0.6916829E-07 6 0.1463335E-07 7 0.2801595E-08 8 0.6992556E-09 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.4871947E-10 1 0.5375528E-01 2 0.1251273E-02 3 0.6915889E-03 4 0.1520605E-04 5 0.8026611E-06 6 0.4108803E-07 7 0.8935486E-08 8 0.6241524E-09 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.2232289E-12 1 0.8265721E-01 2 0.5839266E-02 3 0.1176343E-02 4 0.5583314E-04 5 0.3154173E-05 6 0.3557644E-07 7 0.5255975E-08 8 0.1052295E-08 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.3324131E+00 1 0.1739588E-01 2 0.2942124E-01 3 0.7826548E-03 4 0.2915317E-03 5 0.7515387E-05 6 0.7224623E-07 7 0.9533061E-08 8 0.5910926E-09 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.1159851E-12 1 0.1533326E+00 2 0.5346236E-02 3 0.6372015E-02 4 0.2647680E-03 5 0.1642742E-04 6 0.2296843E-06 7 0.1245403E-07 8 0.1027353E-08 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.4263754E-10 1 0.3355477E-01 2 0.4054840E-01 3 0.1407783E-02 4 0.6288585E-03 5 0.2861555E-04 6 0.4124112E-06 7 0.4706771E-08 8 0.6158811E-09 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.3717793E-05 1 0.5874539E-02 2 0.2593245E-01 3 0.8477853E-02 4 0.6081997E-03 5 0.4509514E-04 6 0.7337403E-06 7 0.6290462E-08 8 0.1064514E-08 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1040332E-10 1 0.4416394E-04 2 0.5423913E-02 3 0.6468980E-02 4 0.1489417E-02 5 0.9868245E-04 6 0.1582676E-05 7 0.2116493E-07 8 0.8142175E-09 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.2561958E-12 1 0.9807660E-05 2 0.5326022E-03 3 0.2062902E-02 4 0.1099134E-02 5 0.1183091E-03 6 0.2025932E-05 7 0.1781094E-07 8 0.5718003E-08 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.4035936E-06 1 0.3872045E-06 2 0.2851187E-04 3 0.3153082E-03 4 0.3075460E-03 5 0.4561912E-04 6 0.9349453E-06 7 0.9606161E-08 8 0.2931011E-08 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.1255548E-11 1 0.4156876E-11 2 0.6878126E-11 3 0.5177669E-11 4 0.3835087E-11 5 0.7117730E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.8081693E-16 1 0.2221305E-11 2 0.1742352E-10 3 0.1084710E-10 4 0.1083891E-10 5 0.8326807E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.8675577E-16 1 0.2667758E-11 2 0.4754468E-10 3 0.1445459E-10 4 0.1412458E-10 5 0.7984500E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.1330168E-11 1 0.4701105E-10 2 0.3873875E-10 3 0.6679494E-10 4 0.2275773E-10 5 0.1365858E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.1115985E-15 1 0.1581120E-08 2 0.1103905E-08 3 0.4607481E-09 4 0.4504780E-10 5 0.2726425E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.2773560E-15 1 0.1754304E-08 2 0.2205189E-08 3 0.4522585E-09 4 0.1483678E-09 5 0.9332077E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.2371242E-07 1 0.1971425E-07 2 0.1585054E-07 3 0.1225290E-08 4 0.8601953E-09 5 0.2744032E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.8564647E-15 1 0.8880787E-08 2 0.2515384E-07 3 0.3788935E-08 4 0.3876070E-08 5 0.9536296E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.1233963E-14 1 0.3234154E-06 2 0.7666525E-07 3 0.3555962E-07 4 0.9119594E-08 5 0.6621300E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.4815964E-10 1 0.6208955E-06 2 0.8309391E-06 3 0.8748067E-07 4 0.3550647E-07 5 0.7089859E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.2218635E-13 1 0.2802820E-04 2 0.1274390E-04 3 0.3989094E-06 4 0.6242630E-07 5 0.2107462E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.1694351E-16 1 0.3714659E-04 2 0.1944912E-04 3 0.3522916E-06 4 0.4583435E-07 5 0.7040291E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.6600915E-03 1 0.5493104E-03 2 0.4088782E-04 3 0.5045266E-06 4 0.2853498E-07 5 0.2587420E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.2018059E-15 1 0.3541234E-03 2 0.4498522E-04 3 0.5158792E-06 4 0.8671413E-07 5 0.2637141E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.4624692E-13 1 0.1518796E-04 2 0.1308264E-04 3 0.5512786E-06 4 0.5282762E-07 5 0.9678776E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.1985968E-07 1 0.3952112E-06 2 0.2319416E-05 3 0.5172081E-06 4 0.4220177E-07 5 0.5945691E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.8131314E-14 1 0.6122561E-06 2 0.4104123E-06 3 0.2219466E-06 4 0.4612248E-07 5 0.8090052E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.1872410E-15 1 0.7246737E-07 2 0.3679522E-07 3 0.4369149E-07 4 0.1083550E-07 5 0.2598862E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.2739113E-08 1 0.2971997E-07 2 0.2314300E-07 3 0.1686628E-07 4 0.4702901E-08 5 0.1040437E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.2417523E-15 1 0.1292241E-07 2 0.1705170E-07 3 0.2725498E-07 4 0.4101900E-08 5 0.2817704E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.1616107E-14 1 0.4881375E-08 2 0.1013790E-08 3 0.2805132E-08 4 0.1860486E-08 5 0.2848025E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.3865482E-12 1 0.7366221E-04 2 0.1879943E-03 3 0.4826430E-05 4 0.1757115E-05 5 0.1307478E-05 6 0.1725838E-06 7 0.3623058E-08 8 0.3015710E-09 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.2870871E-12 1 0.4456608E-05 2 0.1180294E-03 3 0.8612802E-04 4 0.2118435E-04 5 0.1845141E-05 6 0.2232322E-07 7 0.1314696E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.5625781E-07 1 0.7263294E-04 2 0.4084656E-03 3 0.1360993E-03 4 0.5337951E-05 5 0.1698887E-06 6 0.9995289E-08 7 0.1698022E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.9365672E-12 1 0.2120868E-03 2 0.4049216E-03 3 0.1548242E-04 4 0.1411042E-05 5 0.1208968E-05 6 0.5984737E-07 7 0.2935346E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.4690676E-14 1 0.4491236E-03 2 0.2774900E-03 3 0.1051609E-03 4 0.7100876E-05 5 0.1576026E-06 6 0.4592328E-08 7 0.1485163E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.5256515E-04 1 0.7499792E-04 2 0.6197951E-05 3 0.3005576E-05 4 0.1742390E-04 5 0.8284704E-05 6 0.2231622E-06 7 0.3958294E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.2042612E-08 1 0.1083273E-07 2 0.4738434E-07 3 0.2212031E-06 4 0.6316542E-07 5 0.3135052E-08 6 0.1835978E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.5457749E-15 1 0.1046092E-06 2 0.2538681E-05 3 0.2555530E-05 4 0.2524147E-06 5 0.2161925E-07 6 0.4994125E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.8845951E-13 1 0.1060466E-05 2 0.2543079E-04 3 0.1629973E-04 4 0.1629646E-05 5 0.5080818E-07 6 0.1397819E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.2587070E-07 1 0.6765663E-05 2 0.6735329E-05 3 0.2110422E-04 4 0.1749929E-05 5 0.2037836E-07 6 0.1746341E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.4233700E-12 1 0.8262196E-04 2 0.1990885E-03 3 0.1514745E-04 4 0.6788494E-06 5 0.2724823E-07 6 0.8095636E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.8029620E-14 1 0.1504919E-02 2 0.1217304E-03 3 0.8451058E-04 4 0.2176754E-05 5 0.2009023E-07 6 0.4310480E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.2372613E-03 1 0.4337309E-03 2 0.2535434E-03 3 0.3612412E-04 4 0.1439925E-05 5 0.1042057E-06 6 0.8272758E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.2267997E-14 1 0.1008188E-02 2 0.7338092E-03 3 0.2912093E-04 4 0.5458107E-06 5 0.4501017E-07 6 0.2234497E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.3127910E-12 1 0.1496289E-03 2 0.1046972E-02 3 0.1079617E-02 4 0.1648700E-03 5 0.2724936E-05 6 0.9164229E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.4187835E-15 1 0.1751538E-09 2 0.1818250E-09 3 0.1232208E-09 4 0.1599942E-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 -5 0 0.1798797E-15 1 0.7066890E-10 2 0.2069195E-09 3 0.4355701E-09 4 0.1189603E-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 -4 0 0.1779792E-10 1 0.1986113E-09 2 0.1481136E-09 3 0.5030568E-09 4 0.1831058E-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 -3 0 0.5761905E-16 1 0.3605204E-08 2 0.4276960E-08 3 0.5880540E-09 4 0.5575835E-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 -2 0 0.3510643E-16 1 0.1302332E-07 2 0.9380397E-08 3 0.1291184E-07 4 0.2721369E-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 0.2198338E-09 1 0.1587519E-07 2 0.4099536E-08 3 0.1221222E-07 4 0.1659312E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.2983484E-14 1 0.7419203E-06 2 0.1407796E-05 3 0.1103308E-06 4 0.1131392E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.2669719E-16 1 0.2202165E-04 2 0.1938817E-05 3 0.4937537E-07 4 0.9931007E-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 0.3665269E-04 1 0.3914768E-04 2 0.3349577E-05 3 0.8854429E-07 4 0.9645391E-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 0.1637459E-16 1 0.3729901E-04 2 0.1376259E-04 3 0.3023498E-06 4 0.1749341E-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 4 0 0.2173780E-14 1 0.2205311E-05 2 0.3083609E-05 3 0.5368953E-06 4 0.2673838E-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 0.4119866E-08 1 0.3646016E-07 2 0.1062696E-06 3 0.3354612E-07 4 0.2681111E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.9649441E-14 1 0.2740547E-08 2 0.6584030E-08 3 0.2107195E-07 4 0.1345672E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9995546 average vibrational energy (ev) = 0.005198 average rotational energy (ev) = 0.449481 average diffraction energy (ev) = 0.012931 the reaction probability = 0.4454059D-03 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.38986810D+01 trans energy = 0.49285714D+00 trans energy in z = 0.49285714D+00 total momentum = 0.11536724D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9873586E+00 0.2082005E-01 0.4367013E+00 1 0.1524973E-01 0.2455178E-01 0.1284014E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.4763707E-02 0 31 2 -2 0.5065073E-03 0 37 2 -1 0.4820389E-02 0 44 2 0 0.1377304E-01 0 50 2 1 0.5048345E-02 0 56 2 2 0.4320770E-03 0 21 4 -4 0.2309441E-04 0 26 4 -3 0.5044119E-03 0 32 4 -2 0.3648147E-02 0 38 4 -1 0.1202119E-01 0 45 4 0 0.9214817E-02 0 51 4 1 0.1944214E-01 0 57 4 2 0.5595455E-02 0 62 4 3 0.2053454E-02 0 67 4 4 0.3204200E-03 0 13 6 -6 0.2993299E-04 0 17 6 -5 0.1826222E-03 0 22 6 -4 0.9484497E-03 0 27 6 -3 0.2744157E-02 0 33 6 -2 0.6139157E-02 0 39 6 -1 0.1302768E-01 0 46 6 0 0.6722448E-02 0 52 6 1 0.4696190E-01 0 58 6 2 0.3296013E-01 0 63 6 3 0.1318296E-01 0 68 6 4 0.1033333E-01 0 72 6 5 0.1646938E-02 0 76 6 6 0.5763861E-03 0 7 8 -8 0.9799209E-07 0 10 8 -7 0.9741108E-07 0 14 8 -6 0.9384929E-06 0 18 8 -5 0.2153943E-04 0 23 8 -4 0.1310947E-03 0 28 8 -3 0.1358595E-03 0 34 8 -2 0.3449796E-02 0 40 8 -1 0.2830452E-02 0 47 8 0 0.7138546E-01 0 53 8 1 0.9846431E-01 0 59 8 2 0.2380780E+00 0 64 8 3 0.1458176E+00 0 69 8 4 0.8501932E-01 0 73 8 5 0.6747705E-01 0 77 8 6 0.3273802E-01 0 80 8 7 0.1236466E-01 0 83 8 8 0.5287912E-02 0 3 10 -10 0.1117851E-09 0 5 10 -9 0.1838497E-09 0 8 10 -8 0.4714782E-09 0 11 10 -7 0.6144480E-09 0 15 10 -6 0.1106185E-07 0 19 10 -5 0.4603042E-08 0 24 10 -4 0.1939142E-06 0 29 10 -3 0.2507197E-06 0 35 10 -2 0.3750946E-05 0 41 10 -1 0.1268197E-04 0 48 10 0 0.2320130E-03 0 54 10 1 0.3227828E-03 0 60 10 2 0.4090955E-02 0 65 10 3 0.1655525E-02 0 70 10 4 0.1813932E-03 0 74 10 5 0.2398097E-04 0 78 10 6 0.7283187E-05 0 81 10 7 0.9237022E-06 0 84 10 8 0.3417990E-06 0 86 10 9 0.5643023E-06 0 88 10 10 0.3532622E-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 0.4052752E-03 1 31 2 -2 0.4214514E-03 1 37 2 -1 0.1817627E-02 1 44 2 0 0.9606241E-03 1 50 2 1 0.2203153E-03 1 56 2 2 0.2092565E-03 1 21 4 -4 0.3809029E-04 1 26 4 -3 0.7988586E-04 1 32 4 -2 0.3321512E-03 1 38 4 -1 0.3427658E-03 1 45 4 0 0.5725158E-03 1 51 4 1 0.3059098E-02 1 57 4 2 0.1298435E-02 1 62 4 3 0.2935451E-02 1 67 4 4 0.1244060E-02 1 13 6 -6 0.5029588E-08 1 17 6 -5 0.1112691E-07 1 22 6 -4 0.1460303E-07 1 27 6 -3 0.2613780E-06 1 33 6 -2 0.1185482E-05 1 39 6 -1 0.1577279E-05 1 46 6 0 0.2732202E-04 1 52 6 1 0.2250685E-03 1 58 6 2 0.2296010E-03 1 63 6 3 0.5265581E-03 1 68 6 4 0.2365555E-03 1 72 6 5 0.6049673E-04 1 76 6 6 0.4064520E-05 1 7 8 -8 0.3996499E-13 1 10 8 -7 0.8704422E-12 1 14 8 -6 0.5312890E-12 1 18 8 -5 0.3749213E-12 1 23 8 -4 0.1893732E-10 1 28 8 -3 0.6772141E-12 1 34 8 -2 0.1936182E-11 1 40 8 -1 0.3664584E-10 1 47 8 0 0.5287351E-11 1 53 8 1 0.3913279E-10 1 59 8 2 0.2777303E-08 1 64 8 3 0.8287832E-10 1 69 8 4 0.6279358E-10 1 73 8 5 0.7405871E-10 1 77 8 6 0.4762143E-11 1 80 8 7 0.2474269E-10 1 83 8 8 0.1780007E-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 0.8044436E-12 1 0.4015293E-03 2 0.1839628E-02 3 0.1982329E-02 4 0.4836245E-03 5 0.4429173E-04 6 0.5932282E-05 7 0.3866969E-05 8 0.2109395E-05 9 0.3961972E-06 v, j, mj = 0 2 -2 0 0.1176894E-10 1 0.9095464E-05 2 0.1617662E-03 3 0.2827203E-03 4 0.4135219E-04 5 0.2157620E-05 6 0.3742596E-05 7 0.3820270E-05 8 0.1671936E-05 9 0.1807428E-06 v, j, mj = 0 2 -1 0 0.1180985E-07 1 0.1063546E-04 2 0.1940893E-02 3 0.2339228E-02 4 0.4832539E-03 5 0.3371871E-04 6 0.9767203E-05 7 0.2426821E-05 8 0.4305589E-06 9 0.2286756E-07 v, j, mj = 0 2 0 0 0.6592790E-11 1 0.4988535E-03 2 0.4520079E-02 3 0.7102277E-02 4 0.1561937E-02 5 0.7412703E-04 6 0.1038764E-04 7 0.3854286E-05 8 0.1345600E-05 9 0.1820471E-06 v, j, mj = 0 2 1 0 0.7920694E-13 1 0.2356281E-02 2 0.1975483E-02 3 0.4129668E-03 4 0.2506429E-03 5 0.3847856E-04 6 0.1024908E-04 7 0.3126202E-05 8 0.1051568E-05 9 0.6661308E-07 v, j, mj = 0 2 2 0 0.2070006E-03 1 0.1156502E-03 2 0.5342833E-04 3 0.2075387E-04 4 0.4688931E-05 5 0.7359713E-05 6 0.1145922E-04 7 0.7774194E-05 8 0.3524187E-05 9 0.4377000E-06 v, j, mj = 0 4 -4 0 0.4487246E-06 1 0.5184441E-06 2 0.1270995E-06 3 0.1072907E-04 4 0.4304043E-05 5 0.3793948E-05 6 0.1857293E-05 7 0.1057799E-05 8 0.2483992E-06 9 0.9595322E-08 v, j, mj = 0 4 -3 0 0.8612162E-12 1 0.2370158E-05 2 0.1587328E-03 3 0.2756242E-03 4 0.4937015E-04 5 0.1288891E-04 6 0.4283042E-05 7 0.1045342E-05 8 0.9164737E-07 9 0.5631774E-08 v, j, mj = 0 4 -2 0 0.1168029E-10 1 0.7937197E-04 2 0.1313693E-02 3 0.1901422E-02 4 0.3075921E-03 5 0.3803926E-04 6 0.6713217E-05 7 0.1192077E-05 8 0.1175055E-06 9 0.5925112E-08 v, j, mj = 0 4 -1 0 0.2670843E-06 1 0.1727165E-03 2 0.4003859E-02 3 0.6687187E-02 4 0.1057596E-02 5 0.9614395E-04 6 0.3045521E-05 7 0.3197078E-06 8 0.5214113E-07 9 0.5450927E-08 v, j, mj = 0 4 0 0 0.7925547E-11 1 0.1181131E-05 2 0.1822181E-02 3 0.6619836E-02 4 0.7491918E-03 5 0.1888531E-04 6 0.2567795E-05 7 0.7875264E-06 8 0.1759395E-06 9 0.1061419E-07 v, j, mj = 0 4 1 0 0.5364552E-12 1 0.4975350E-02 2 0.1161732E-01 3 0.2018655E-02 4 0.7643244E-03 5 0.6149422E-04 6 0.3765732E-05 7 0.1079110E-05 8 0.1480034E-06 9 0.5387266E-08 v, j, mj = 0 4 2 0 0.1970822E-02 1 0.2117635E-02 2 0.8001840E-03 3 0.3776793E-03 4 0.2366304E-03 5 0.7160503E-04 6 0.1592692E-04 7 0.4412791E-05 8 0.5441568E-06 9 0.1564610E-07 v, j, mj = 0 4 3 0 0.2680951E-12 1 0.1717588E-02 2 0.2204754E-03 3 0.3843410E-04 4 0.2756610E-04 5 0.2980355E-04 6 0.1485676E-04 7 0.4195180E-05 8 0.5237539E-06 9 0.1107327E-07 v, j, mj = 0 4 4 0 0.9122345E-12 1 0.1047158E-03 2 0.8511236E-04 3 0.4112840E-04 4 0.1542647E-04 5 0.3777459E-04 6 0.2557608E-04 7 0.9419138E-05 8 0.1236845E-05 9 0.3026403E-07 v, j, mj = 0 6 -6 0 0.1983892E-12 1 0.3990627E-06 2 0.3868384E-06 3 0.6769461E-05 4 0.1801399E-04 5 0.3115679E-05 6 0.1067078E-05 7 0.1742636E-06 8 0.5419936E-08 9 0.1198888E-08 v, j, mj = 0 6 -5 0 0.7694516E-12 1 0.9793024E-06 2 0.5530270E-05 3 0.9171445E-04 4 0.7859762E-04 5 0.4509033E-05 6 0.1118021E-05 7 0.1655664E-06 8 0.6394458E-08 9 0.1517042E-08 v, j, mj = 0 6 -4 0 0.6321305E-06 1 0.3456604E-05 2 0.1078047E-03 3 0.6970794E-03 4 0.1363119E-03 5 0.2609153E-05 6 0.4861625E-06 7 0.6584560E-07 8 0.2204472E-08 9 0.1691472E-08 v, j, mj = 0 6 -3 0 0.2860451E-12 1 0.1458381E-04 2 0.8599013E-03 3 0.1651935E-02 4 0.2081648E-03 5 0.9012222E-05 6 0.4833430E-06 7 0.7072605E-07 8 0.4547742E-08 9 0.1175731E-08 v, j, mj = 0 6 -2 0 0.1296515E-10 1 0.2164998E-03 2 0.2048155E-02 3 0.2962788E-02 4 0.8790256E-03 5 0.3231492E-04 6 0.3338448E-06 7 0.3613880E-07 8 0.3711856E-08 9 0.5194446E-09 v, j, mj = 0 6 -1 0 0.1252040E-05 1 0.1025579E-02 2 0.3356514E-02 3 0.7131741E-02 4 0.1492002E-02 5 0.2044801E-04 6 0.1160538E-06 7 0.2539936E-07 8 0.3184788E-08 9 0.1730151E-08 v, j, mj = 0 6 0 0 0.5062621E-10 1 0.1190785E-02 2 0.8419354E-03 3 0.3988360E-02 4 0.6867563E-03 5 0.1394685E-04 6 0.6161634E-06 7 0.3983336E-07 8 0.7049433E-08 9 0.8481199E-09 v, j, mj = 0 6 1 0 0.2492591E-12 1 0.1120540E-01 2 0.3321072E-01 3 0.1665367E-02 4 0.8660259E-03 5 0.1329488E-04 6 0.1012894E-05 7 0.7378292E-07 8 0.2962628E-08 9 0.1525982E-08 v, j, mj = 0 6 2 0 0.5449495E-02 1 0.1395988E-01 2 0.2689563E-02 3 0.1068033E-01 4 0.1245802E-03 5 0.5220950E-04 6 0.3899745E-05 7 0.1593650E-06 8 0.5733442E-08 9 0.2291907E-08 v, j, mj = 0 6 3 0 0.1655281E-12 1 0.7571686E-02 2 0.3159777E-02 3 0.1713540E-02 4 0.6540568E-03 5 0.7293411E-04 6 0.1025641E-04 7 0.6984618E-06 8 0.1377027E-07 9 0.1486868E-08 v, j, mj = 0 6 4 0 0.4077478E-11 1 0.4191184E-02 2 0.2967397E-02 3 0.2742391E-02 4 0.3233281E-03 5 0.9182140E-04 6 0.1614575E-04 7 0.1044347E-05 8 0.1951478E-07 9 0.1304637E-08 v, j, mj = 0 6 5 0 0.3161940E-06 1 0.1775239E-03 2 0.3709012E-03 3 0.7029665E-03 4 0.2483286E-03 5 0.1184312E-03 6 0.2681694E-04 7 0.1630821E-05 8 0.2097800E-07 9 0.1761401E-08 v, j, mj = 0 6 6 0 0.2755544E-11 1 0.3918244E-05 2 0.1917751E-03 3 0.1968852E-03 4 0.8670775E-04 5 0.6416241E-04 6 0.2962854E-04 7 0.3244427E-05 8 0.6303606E-07 9 0.1386240E-08 v, j, mj = 0 8 -8 0 0.8350868E-13 1 0.7723881E-08 2 0.5095883E-07 3 0.1660969E-07 4 0.1490010E-07 5 0.6462984E-08 6 0.4137570E-09 7 0.6738897E-09 8 0.2488831E-09 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.3426986E-09 1 0.3379481E-07 2 0.1643986E-07 3 0.1096574E-07 4 0.2542669E-07 5 0.8457483E-08 6 0.7915155E-09 7 0.7995389E-09 8 0.3927389E-09 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.6210126E-13 1 0.1138937E-06 2 0.7279389E-07 3 0.1925203E-06 4 0.4842352E-06 5 0.6798934E-07 6 0.4003394E-08 7 0.2559795E-08 8 0.4972067E-09 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.4969431E-15 1 0.5412637E-06 2 0.8368504E-06 3 0.1397498E-04 4 0.5952161E-05 5 0.2234875E-06 6 0.7847130E-08 7 0.2467920E-08 8 0.3654148E-09 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1118311E-05 1 0.1102274E-06 2 0.4053330E-04 3 0.8454892E-04 4 0.4747488E-05 5 0.1692913E-07 6 0.1778565E-07 7 0.1449218E-08 8 0.2842700E-09 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.2168692E-12 1 0.4933012E-05 2 0.5400241E-04 3 0.6449839E-04 4 0.1226217E-04 5 0.1516511E-06 6 0.1090583E-07 7 0.4652394E-09 8 0.5104202E-09 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.8782771E-11 1 0.6800683E-03 2 0.2454127E-02 3 0.2829144E-03 4 0.3240643E-04 5 0.2324448E-06 6 0.3349124E-07 7 0.1183592E-07 8 0.1586253E-08 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.5368727E-06 1 0.7083153E-03 2 0.1723653E-02 3 0.3753099E-03 4 0.2168273E-04 5 0.9213856E-06 6 0.2778382E-07 7 0.3741184E-08 8 0.8317644E-09 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.1926807E-09 1 0.6578653E-01 2 0.4741298E-02 3 0.8281042E-03 4 0.2653741E-04 5 0.2950206E-05 6 0.2241458E-07 7 0.1343543E-07 8 0.1439422E-08 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.7983908E-12 1 0.7093109E-01 2 0.2686092E-01 3 0.3818091E-03 4 0.2839255E-03 5 0.6334059E-05 6 0.2324606E-06 7 0.6215729E-08 8 0.2064117E-08 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.1630487E+00 1 0.4433748E-01 2 0.2341117E-01 3 0.6946512E-02 4 0.3082229E-03 5 0.2521636E-04 6 0.6888892E-06 7 0.3732959E-08 8 0.1425786E-08 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.6308568E-12 1 0.1132141E+00 2 0.2526371E-01 3 0.6633034E-02 4 0.6427033E-03 5 0.6273064E-04 6 0.1378667E-05 7 0.1805553E-07 8 0.1879816E-08 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.1505702E-09 1 0.5073886E-01 2 0.2729683E-01 3 0.5538501E-02 4 0.1351491E-02 5 0.9049037E-04 6 0.3133864E-05 7 0.1975845E-07 8 0.1519955E-08 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1315612E-04 1 0.1459563E-01 2 0.4571423E-01 3 0.6121727E-02 4 0.8672112E-03 5 0.1602599E-03 6 0.4730020E-05 7 0.9666770E-07 8 0.1903915E-08 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.5128939E-10 1 0.1976363E-03 2 0.1787779E-01 3 0.1242662E-01 4 0.1946834E-02 5 0.2774543E-03 6 0.1154664E-04 7 0.1297958E-06 8 0.2888372E-08 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.2149799E-11 1 0.5620934E-04 2 0.2478547E-02 3 0.6449072E-02 4 0.2836940E-02 5 0.5188034E-03 6 0.2478781E-04 7 0.2985213E-06 8 0.5671168E-08 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.6593891E-05 1 0.7569680E-05 2 0.2580151E-03 3 0.2252184E-02 4 0.2202503E-02 5 0.5354534E-03 6 0.2540986E-04 7 0.1809605E-06 8 0.2562582E-08 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.6991785E-11 1 0.1309021E-10 2 0.2591871E-10 3 0.2190402E-10 4 0.1202465E-10 5 0.2059282E-10 6 0.1126286E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.3647768E-16 1 0.1369201E-10 2 0.7616802E-10 3 0.4377751E-10 4 0.1904429E-10 5 0.2427150E-10 6 0.6896285E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.2473355E-15 1 0.1237887E-10 2 0.2576717E-09 3 0.1026665E-09 4 0.7826529E-10 5 0.9965346E-11 6 0.1053027E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.2719472E-12 1 0.1583926E-09 2 0.9140944E-10 3 0.2229558E-09 4 0.8299539E-10 5 0.4249351E-10 6 0.1592931E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.3573551E-15 1 0.5597051E-08 2 0.3955325E-08 3 0.1051628E-08 4 0.3447055E-09 5 0.8582882E-10 6 0.2730719E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.1869796E-14 1 0.2892676E-09 2 0.7149272E-09 3 0.2749488E-08 4 0.4285407E-09 5 0.3486588E-09 6 0.7215831E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.9182382E-07 1 0.4881121E-07 2 0.3936715E-07 3 0.9417894E-08 4 0.3037915E-08 5 0.1346550E-08 6 0.1096974E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.3053352E-14 1 0.4448927E-07 2 0.1264855E-06 3 0.6930856E-07 4 0.8002106E-08 5 0.2220676E-08 6 0.2135394E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.7902950E-14 1 0.8290129E-06 2 0.2570871E-05 3 0.3161498E-06 4 0.2779835E-07 5 0.6950872E-08 6 0.1635299E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.1063070E-07 1 0.4045343E-05 2 0.8186891E-05 3 0.3757219E-06 4 0.4605869E-07 5 0.1500679E-07 6 0.2321682E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.2455282E-12 1 0.1641148E-03 2 0.6642318E-04 3 0.1353966E-05 4 0.1029736E-06 5 0.1590784E-07 6 0.2224187E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.1624924E-16 1 0.2245680E-03 2 0.9638476E-04 3 0.1766686E-05 4 0.4858420E-07 5 0.1359890E-07 6 0.1179125E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.2500463E-02 1 0.1499561E-02 2 0.9000885E-04 3 0.7437841E-06 4 0.1595147E-06 5 0.1604880E-07 6 0.1939871E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.7180008E-16 1 0.1555893E-02 2 0.9758032E-04 3 0.1882957E-05 4 0.8778610E-07 5 0.7230031E-07 6 0.8278665E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.4214483E-12 1 0.1002057E-03 2 0.7882874E-04 3 0.2269084E-05 4 0.6744214E-07 5 0.1960489E-07 6 0.2557261E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.5000951E-09 1 0.4985902E-05 2 0.1606604E-04 3 0.2848843E-05 4 0.6285897E-07 5 0.1469112E-07 6 0.2137189E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.1271156E-12 1 0.8691261E-06 2 0.5108903E-05 3 0.1259854E-05 4 0.3391497E-07 5 0.8531864E-08 6 0.2856719E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.4118976E-14 1 0.1145117E-06 2 0.3878144E-06 3 0.3721604E-06 4 0.3701110E-07 5 0.9904938E-08 6 0.2299596E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.9339285E-07 1 0.6788045E-07 2 0.4116865E-07 3 0.1204615E-06 4 0.1494424E-07 5 0.2926886E-08 6 0.1024447E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.1721468E-14 1 0.2617125E-06 2 0.2013518E-06 3 0.7718838E-07 4 0.1743270E-07 5 0.5582260E-08 6 0.1034681E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.1164012E-13 1 0.7795052E-07 2 0.1559649E-06 3 0.8908975E-07 4 0.1964379E-07 5 0.8803186E-08 6 0.1810116E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.2758994E-11 1 0.6175394E-04 2 0.3072312E-03 3 0.2767724E-04 4 0.2648007E-05 5 0.4418631E-05 6 0.1516694E-05 7 0.2861763E-07 8 0.8919696E-09 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.3827532E-11 1 0.1050394E-04 2 0.3053094E-03 3 0.8599796E-04 4 0.1263054E-04 5 0.6480815E-05 6 0.5213165E-06 7 0.6903001E-08 8 0.5269980E-09 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.4125230E-06 1 0.3521341E-03 2 0.1308928E-02 3 0.1369170E-03 4 0.1761869E-04 5 0.1568059E-05 6 0.4758465E-07 7 0.1517001E-08 8 0.2889818E-09 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.5376217E-11 1 0.3032063E-03 2 0.5642567E-03 3 0.7964314E-04 4 0.8151804E-05 5 0.4427449E-05 6 0.9209463E-06 7 0.1641524E-07 8 0.1313238E-08 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.4815743E-12 1 0.6943602E-04 2 0.1043709E-03 3 0.2649112E-04 4 0.1868281E-04 5 0.1300405E-05 6 0.3228214E-07 7 0.1499613E-08 8 0.2189122E-09 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.1769040E-04 1 0.1260005E-03 2 0.4487790E-04 3 0.2756208E-05 4 0.5691801E-05 5 0.1032705E-04 6 0.1900178E-05 7 0.1198244E-07 8 0.4914139E-09 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.1608354E-06 1 0.3378708E-06 2 0.4085570E-05 3 0.2412405E-04 4 0.8942341E-05 5 0.4347766E-06 6 0.4618472E-08 7 0.2232496E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.5275264E-13 1 0.1020413E-05 2 0.3929789E-04 3 0.3505433E-04 4 0.4412987E-05 5 0.9752093E-07 6 0.2289241E-08 7 0.4306426E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.3694125E-12 1 0.1102982E-04 2 0.2405947E-03 3 0.7856792E-04 4 0.1700561E-05 5 0.2484938E-06 6 0.9442990E-08 7 0.2444705E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.3620619E-07 1 0.1820046E-04 2 0.1537741E-03 3 0.1655650E-03 4 0.4996772E-05 5 0.1885838E-06 6 0.3626250E-08 7 0.9488428E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.3141584E-11 1 0.8884894E-04 2 0.3649883E-03 3 0.1128391E-03 4 0.5539270E-05 5 0.2820687E-06 6 0.1568201E-07 7 0.2388593E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.2491922E-12 1 0.2361471E-02 2 0.5697375E-03 3 0.1270047E-03 4 0.7976884E-06 5 0.7919797E-07 6 0.6866398E-08 7 0.7498721E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.1189315E-03 1 0.1198041E-03 2 0.9287408E-03 3 0.1242581E-03 4 0.6470419E-05 5 0.2057642E-06 6 0.2340303E-07 7 0.1181140E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.8537485E-13 1 0.1126591E-02 2 0.1532564E-02 3 0.2645729E-03 4 0.1142720E-04 5 0.2901351E-06 6 0.5623041E-08 7 0.7209569E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.3425729E-11 1 0.2980240E-03 2 0.7470428E-03 3 0.1244193E-03 4 0.6732368E-04 5 0.7194429E-05 6 0.5470990E-07 7 0.9437514E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.1473455E-13 1 0.5336311E-09 2 0.1507668E-08 3 0.2013666E-08 4 0.3612780E-09 5 0.6133309E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.6196826E-14 1 0.6841896E-08 2 0.3431854E-08 3 0.3978218E-09 4 0.2073497E-09 5 0.2479837E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.3870255E-08 1 0.1418195E-08 2 0.3464696E-08 3 0.3215999E-08 4 0.2257228E-08 5 0.3766553E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.1551814E-14 1 0.2340824E-07 2 0.1132512E-06 3 0.1174902E-06 4 0.6302233E-08 5 0.9260917E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.4889026E-14 1 0.1508567E-06 2 0.6031221E-06 3 0.4168887E-06 4 0.1324308E-07 5 0.1371781E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.2336499E-08 1 0.1041531E-06 2 0.8371491E-06 3 0.5901398E-06 4 0.4113953E-07 5 0.2360682E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.2975393E-13 1 0.1107409E-04 2 0.1533691E-04 3 0.8588039E-06 4 0.4900838E-07 5 0.3213811E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.1295019E-14 1 0.2075467E-03 2 0.1466107E-04 3 0.2796331E-05 4 0.5551988E-07 5 0.8927948E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.9756357E-04 1 0.7654482E-04 2 0.5001825E-04 3 0.5406607E-05 4 0.6399322E-07 5 0.3768012E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.5153340E-15 1 0.3836249E-03 2 0.1391784E-03 3 0.3741233E-05 4 0.1000286E-07 5 0.3594346E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.8159383E-13 1 0.8722407E-04 2 0.1372875E-03 3 0.1193245E-04 4 0.1018393E-06 5 0.9604210E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.5085241E-08 1 0.6421170E-05 2 0.4265577E-04 3 0.1113825E-04 4 0.2746862E-06 5 0.1777613E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.1746474E-12 1 0.6121470E-08 2 0.2397698E-05 3 0.1568228E-05 4 0.8927788E-07 5 0.3194433E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -8 0 0.1536808E-15 1 0.3981131E-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 0.8516198E-12 1 0.1882244E-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 -6 0 0.1444281E-16 1 0.5312746E-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 -5 0 0.1295504E-17 1 0.3749200E-12 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -4 0 0.1858491E-10 1 0.3524151E-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 -3 0 0.5638137E-18 1 0.6772135E-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 0.1831718E-18 1 0.1936182E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -1 0 0.2816882E-10 1 0.8477024E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 0 0 0.1922723E-17 1 0.5287349E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 1 0 0.3711942E-17 1 0.3913279E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 2 0 0.2595644E-08 1 0.1816591E-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 3 0 0.2953832E-19 1 0.8287832E-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 0.1537782E-16 1 0.6279356E-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 0.2071068E-10 1 0.5334803E-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 6 0 0.1396952E-16 1 0.4762129E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 7 0 0.7058073E-16 1 0.2474262E-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 8 0 0.1393195E-10 1 0.3868125E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 1.0026083 average vibrational energy (ev) = 0.007748 average rotational energy (ev) = 0.432012 average diffraction energy (ev) = 0.020877 the reaction probability = -0.2608285D-02 etrans(icomin)= 0.151114 etrans(icomax)= 0.548327 etrans= 0.550000 CPU TIMES Total computation 166329.0732 (a) ... Propagating the wavefunction 163207.9161 (b) Setup time 2684.4609 Saving the wave function for rerun 113.9109 Calculating averages 8.6140 Calculating and saving BK-coeffs 34.9195 Asymptotic analysis 8.6613 Saving the flux coefficients 0.0000 Flux analysis 0.0000 ----------------------------------------------------- Sum 166058.4828 (a) ... FFTs along X and Y 8417.4289 Kinetic energy operation along Z 40213.3242 Kinetic energy operation along r 32789.2869 Potential energy multiplication 19271.3757 Legengre transforms 48842.7892 Shifting the wavefunction 4716.2340 Kinetic energy multiplications (xy) 1065.2115 Absorbing the wavefunction 1360.8138 Projection formalism 22.9665 Operations on specular grid 0.1683 ----------------------------------------------------- Sum 156699.5988 (b) ... Potential initialisation time 0.0000 Potential setup time 2610.1409 FFTs along X 4699.0469 FFTs along Y 3718.3820 Time spent on FGH for asympwf 0.5068 Ending date and time: Tue Aug 13 11:40:45 CEST 2019