Starting date and time: Tue Aug 13 15:41:01 CEST 2019 Calculation run on nodes/processors: *** SPO-DVR program version 5.16 (Compiled using IFORT for X86 on Jul 5 2019 at 10:16:08) run on 20190813 at 154102.067 *** * 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: v0j8mj7-0.15eV-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: 7 * 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: 7 * 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 = 7 ... *** 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 = 0.63896179E-04 secs * Grids are setup! * 5-Mode arrays are allocated! * 4-Mode arrays are allocated! ******************************************************************************** INFO FROM SETTING UP THE INTERACTION POTENTIAL ******************************************************************************** * Setting up the Cu111_B86SRP68-DF2_Z8A_C3v PES... Number of points in Z for which the potential is calculated = 162 Number of points in r for which the potential is calculated = 56 Number of points in x for which the potential is calculated = 20 Number of points in y for which the potential is calculated = 20 Number of points in theta for which the potential is calculated = 17 Number of points in phi for which the potential is calculated = 66 iz = 1 iz = 2 iz = 3 iz = 4 iz = 5 iz = 6 iz = 7 iz = 8 iz = 9 iz = 10 iz = 11 iz = 12 iz = 13 iz = 14 iz = 15 iz = 16 iz = 17 iz = 18 iz = 19 iz = 20 iz = 21 iz = 22 iz = 23 iz = 24 iz = 25 iz = 26 iz = 27 iz = 28 iz = 29 iz = 30 iz = 31 iz = 32 iz = 33 iz = 34 iz = 35 iz = 36 iz = 37 iz = 38 iz = 39 iz = 40 iz = 41 iz = 42 iz = 43 iz = 44 iz = 45 iz = 46 iz = 47 iz = 48 iz = 49 iz = 50 iz = 51 iz = 52 iz = 53 iz = 54 iz = 55 iz = 56 iz = 57 iz = 58 iz = 59 iz = 60 iz = 61 iz = 62 iz = 63 iz = 64 iz = 65 iz = 66 iz = 67 iz = 68 iz = 69 iz = 70 iz = 71 iz = 72 iz = 73 iz = 74 iz = 75 iz = 76 iz = 77 iz = 78 iz = 79 iz = 80 iz = 81 iz = 82 iz = 83 iz = 84 iz = 85 iz = 86 iz = 87 iz = 88 iz = 89 iz = 90 iz = 91 iz = 92 iz = 93 iz = 94 iz = 95 iz = 96 iz = 97 iz = 98 iz = 99 iz = 100 iz = 101 iz = 102 iz = 103 iz = 104 iz = 105 iz = 106 iz = 107 iz = 108 iz = 109 iz = 110 iz = 111 iz = 112 iz = 113 iz = 114 iz = 115 iz = 116 iz = 117 iz = 118 iz = 119 iz = 120 iz = 121 iz = 122 iz = 123 iz = 124 iz = 125 iz = 126 iz = 127 iz = 128 iz = 129 iz = 130 iz = 131 iz = 132 iz = 133 iz = 134 iz = 135 iz = 136 iz = 137 iz = 138 iz = 139 iz = 140 iz = 141 iz = 142 iz = 145 iz = 144 iz = 149 iz = 148 iz = 152 iz = 153 iz = 156 iz = 146 iz = 157 iz = 143 iz = 160 iz = 161 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 = 0.26429169E+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 = 380 ******************************************************************************** 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 = 21410 ******************************************************************************** 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 1.53575903 0.23771132E-01 0.14000000E+04 0.99999977 13.86493454 1.53575531 0.16830009E-01 0.14500000E+04 0.99999976 13.73855600 1.53575544 0.11939073E-01 0.15000000E+04 0.99999975 13.61215542 1.53576520 0.84968641E-02 0.15500000E+04 0.99999975 13.48573073 1.53577652 0.60728911E-02 0.16000000E+04 0.99999974 13.35927954 1.53577882 0.43625372E-02 0.16500000E+04 0.99999973 13.23279913 1.53578225 0.31518931E-02 0.17000000E+04 0.99999972 13.10628639 1.53578969 0.22914455E-02 0.17500000E+04 0.99999971 12.97973785 1.53579692 0.16769331E-02 0.18000000E+04 0.99999970 12.85314963 1.53580952 0.12356814E-02 0.18500000E+04 0.99999970 12.72651750 1.53583255 0.91698061E-03 0.19000000E+04 0.99999969 12.59983691 1.53586136 0.68536716E-03 0.19500000E+04 0.99999968 12.47310298 1.53588389 0.51596038E-03 0.20000000E+04 0.99999967 12.34631061 1.53590464 0.39123502E-03 0.20500000E+04 0.99999966 12.21945446 1.53593308 0.29879171E-03 0.21000000E+04 0.99999965 12.09252907 1.53596212 0.22981304E-03 0.21500000E+04 0.99999965 11.96552878 1.53599560 0.17799618E-03 0.22000000E+04 0.99999964 11.83844788 1.53603818 0.13881060E-03 0.22500000E+04 0.99999963 11.71128054 1.53608761 0.10898069E-03 0.23000000E+04 0.99999962 11.58402084 1.53613181 0.86124890E-04 0.23500000E+04 0.99999961 11.45666282 1.53617017 0.68500167E-04 0.24000000E+04 0.99999961 11.32920042 1.53621465 0.54823694E-04 0.24500000E+04 0.99999960 11.20162756 1.53626194 0.44145484E-04 0.25000000E+04 0.99999959 11.07393810 1.53630939 0.35757830E-04 0.25500000E+04 0.99999958 10.94612588 1.53636528 0.29130428E-04 0.26000000E+04 0.99999957 10.81818476 1.53642656 0.23863621E-04 0.26500000E+04 0.99999956 10.69010867 1.53648473 0.19654267E-04 0.27000000E+04 0.99999956 10.56189165 1.53653430 0.16272056E-04 0.27500000E+04 0.99999955 10.43352797 1.53658692 0.13539843E-04 0.28000000E+04 0.99999954 10.30501218 1.53664573 0.11321363E-04 0.28500000E+04 0.99999953 10.17633931 1.53670325 0.95110594E-05 0.29000000E+04 0.99999952 10.04750496 1.53676727 0.80267288E-05 0.29500000E+04 0.99999952 9.91850551 1.53683838 0.68037994E-05 0.30000000E+04 0.99999951 9.78933832 1.53690799 0.57920904E-05 0.30500000E+04 0.99999950 9.66000200 1.53697037 0.49513151E-05 0.31000000E+04 0.99999949 9.53049663 1.53703376 0.42496243E-05 0.31500000E+04 0.99999948 9.40082413 1.53710717 0.36615798E-05 0.32000000E+04 0.99999947 9.27098853 1.53718425 0.31667910E-05 0.32500000E+04 0.99999947 9.14099639 1.53726749 0.27488489E-05 0.33000000E+04 0.99999946 9.01085715 1.53736484 0.23944801E-05 0.33500000E+04 0.99999945 8.88058359 1.53746803 0.20928880E-05 0.34000000E+04 0.99999944 8.75019223 1.53757385 0.18352591E-05 0.34500000E+04 0.99999943 8.61970381 1.53768851 0.16143955E-05 0.35000000E+04 0.99999942 8.48914372 1.53782740 0.14244198E-05 0.35500000E+04 0.99999942 8.35854248 1.53799048 0.12602804E-05 0.36000000E+04 0.99999941 8.22793619 1.53817902 0.11184651E-05 0.36500000E+04 0.99999940 8.09736695 1.53840715 0.99537585E-06 0.37000000E+04 0.99999939 7.96688329 1.53867677 0.88819443E-06 0.37500000E+04 0.99999938 7.83654052 1.53898742 0.79456875E-06 0.38000000E+04 0.99999936 7.70640108 1.53935276 0.71255470E-06 0.38500000E+04 0.99999935 7.57653483 1.53979391 0.64054203E-06 0.39000000E+04 0.99999932 7.44701928 1.54032701 0.57717607E-06 0.39500000E+04 0.99999927 7.31793973 1.54095832 0.52109326E-06 0.40000000E+04 0.99999918 7.18938935 1.54170989 0.47171344E-06 0.40500000E+04 0.99999904 7.06146924 1.54260093 0.42796240E-06 0.41000000E+04 0.99999879 6.93428827 1.54363905 0.38908908E-06 0.41500000E+04 0.99999838 6.80796303 1.54484623 0.35443550E-06 0.42000000E+04 0.99999770 6.68261748 1.54625171 0.32343945E-06 0.42500000E+04 0.99999661 6.55838265 1.54788205 0.29564862E-06 0.43000000E+04 0.99999490 6.43539622 1.54975080 0.27071713E-06 0.43500000E+04 0.99999227 6.31380194 1.55187500 0.24817238E-06 0.44000000E+04 0.99998832 6.19374908 1.55427593 0.22814981E-06 0.44500000E+04 0.99998250 6.07539176 1.55695752 0.21016514E-06 0.45000000E+04 0.99997411 5.95888821 1.55992263 0.19393416E-06 0.45500000E+04 0.99996225 5.84440005 1.56318223 0.17920831E-06 0.46000000E+04 0.99994579 5.73209146 1.56673701 0.16580193E-06 0.46500000E+04 0.99992336 5.62212837 1.57057401 0.15358582E-06 0.47000000E+04 0.99989330 5.51467766 1.57466926 0.14245934E-06 0.47500000E+04 0.99985369 5.40990621 1.57900235 0.13232854E-06 0.48000000E+04 0.99980232 5.30798010 1.58354062 0.12310445E-06 0.48500000E+04 0.99973670 5.20906356 1.58824256 0.11471027E-06 0.49000000E+04 0.99965413 5.11331793 1.59307570 0.10707884E-06 0.49500000E+04 0.99955167 5.02090055 1.59800800 0.99935492E-07 0.50000000E+04 0.99942628 4.93196348 1.60299874 0.93610659E-07 0.50500000E+04 0.99927484 4.84665232 1.60800145 0.87811442E-07 0.51000000E+04 0.99909425 4.76510507 1.61296989 0.82454244E-07 0.51500000E+04 0.99888154 4.68745125 1.61785546 0.77475588E-07 0.52000000E+04 0.99863397 4.61381125 1.62259679 0.72836048E-07 0.52500000E+04 0.99834907 4.54429601 1.62713310 0.68512512E-07 0.53000000E+04 0.99802483 4.47900706 1.63140437 0.64487321E-07 0.53500000E+04 0.99765967 4.41803687 1.63534103 0.60742884E-07 0.54000000E+04 0.99725261 4.36146951 1.63886651 0.57262137E-07 0.54500000E+04 0.99680321 4.30938155 1.64190425 0.54030591E-07 0.55000000E+04 0.99631170 4.26184297 1.64438481 0.50847280E-07 0.55500000E+04 0.99577894 4.21891801 1.64624460 0.48089214E-07 0.56000000E+04 0.99520644 4.18066560 1.64743371 0.45537251E-07 0.56500000E+04 0.99459638 4.14713910 1.64792621 0.43178171E-07 0.57000000E+04 0.99395161 4.11838551 1.64771721 0.40992227E-07 0.57500000E+04 0.99327565 4.09444383 1.64682541 0.38961271E-07 0.58000000E+04 0.99257271 4.07534295 1.64530006 0.37062819E-07 0.58500000E+04 0.99184771 4.06109899 1.64321938 0.35281804E-07 0.59000000E+04 0.99110626 4.05171285 1.64067794 0.33649507E-07 0.59500000E+04 0.99035464 4.04716808 1.63776691 0.32125606E-07 0.60000000E+04 0.98959974 4.04742998 1.63456115 0.30645735E-07 0.60500000E+04 0.98884895 4.05244602 1.63110510 0.29275654E-07 0.61000000E+04 0.98810997 4.06214794 1.62740794 0.27974291E-07 0.61500000E+04 0.98739060 4.07645503 1.62345725 0.26694824E-07 0.62000000E+04 0.98669842 4.09527796 1.61924392 0.25432117E-07 0.62500000E+04 0.98604056 4.11852237 1.61479008 0.24367743E-07 0.63000000E+04 0.98542332 4.14609131 1.61016987 0.23141961E-07 0.63500000E+04 0.98485195 4.17788604 1.60551344 0.22165198E-07 0.64000000E+04 0.98433039 4.21380533 1.60098501 0.21392514E-07 0.64500000E+04 0.98386116 4.25374399 1.59673679 0.20279769E-07 0.65000000E+04 0.98344524 4.29759153 1.59286267 0.19273917E-07 0.65500000E+04 0.98308217 4.34523210 1.58936930 0.18841033E-07 0.66000000E+04 0.98277009 4.39654600 1.58617722 0.18107534E-07 0.66500000E+04 0.98250599 4.45141274 1.58315612 0.16892935E-07 0.67000000E+04 0.98228591 4.50971453 1.58018298 0.16457259E-07 0.67500000E+04 0.98210528 4.57133910 1.57719889 0.16650242E-07 0.68000000E+04 0.98195919 4.63618069 1.57423564 0.15894158E-07 0.68500000E+04 0.98184262 4.70413891 1.57140064 0.14605839E-07 0.69000000E+04 0.98175075 4.77511583 1.56882663 0.14686390E-07 0.69500000E+04 0.98167911 4.84901255 1.56660712 0.15585626E-07 ==> ZAnalysis on specular channel fixed at Z = 0.16700000E+02 0.70000000E+04 0.98162370 4.92572646 1.56474872 0.15278654E-07 0.70500000E+04 0.98158107 5.00515042 1.56316402 0.13728287E-07 0.71000000E+04 0.98154836 5.08717385 1.56170838 0.13904797E-07 0.71500000E+04 0.98152324 5.17168535 1.56024212 0.16701528E-07 0.72000000E+04 0.98150386 5.25857562 1.55868818 0.18960040E-07 0.72500000E+04 0.98148879 5.34773935 1.55705991 0.18266553E-07 0.73000000E+04 0.98147693 5.43907563 1.55544613 0.18498872E-07 0.73500000E+04 0.98146743 5.53248663 1.55396241 0.26254301E-07 0.74000000E+04 0.98145963 5.62787562 1.55269378 0.40606800E-07 0.74500000E+04 0.98145304 5.72514513 1.55165577 0.53485843E-07 0.75000000E+04 0.98144725 5.82419638 1.55079028 0.65580480E-07 0.75500000E+04 0.98144191 5.92493009 1.54999565 0.93334745E-07 0.76000000E+04 0.98143671 6.02724833 1.54917565 0.14918904E-06 0.76500000E+04 0.98143136 6.13105640 1.54828297 0.22289476E-06 0.77000000E+04 0.98142556 6.23626403 1.54733658 0.29936417E-06 0.77500000E+04 0.98141896 6.34278525 1.54640666 0.39088411E-06 0.78000000E+04 0.98141119 6.45053722 1.54557612 0.53030585E-06 0.78500000E+04 0.98140180 6.55943870 1.54489798 0.72881034E-06 0.79000000E+04 0.98139026 6.66940881 1.54436909 0.96124737E-06 0.79500000E+04 0.98137594 6.78036688 1.54393300 0.12055234E-05 0.80000000E+04 0.98135812 6.89223303 1.54351009 0.14847356E-05 0.80500000E+04 0.98133594 7.00492934 1.54303863 0.18596811E-05 0.81000000E+04 0.98130838 7.11838074 1.54250507 0.23874679E-05 0.81500000E+04 0.98127429 7.23251523 1.54194819 0.31019745E-05 0.82000000E+04 0.98123234 7.34726334 1.54143494 0.40452381E-05 0.82500000E+04 0.98118100 7.46255712 1.54102183 0.53298034E-05 0.83000000E+04 0.98111851 7.57832914 1.54072309 0.71792195E-05 0.83500000E+04 0.98104292 7.69451214 1.54050362 0.99015128E-05 0.84000000E+04 0.98095201 7.81103908 1.54029986 0.13813266E-04 0.84500000E+04 0.98084327 7.92784376 1.54005633 0.19203034E-04 0.85000000E+04 0.98071394 8.04486138 1.53975632 0.26401391E-04 0.85500000E+04 0.98056092 8.16202867 1.53942878 0.35892815E-04 0.86000000E+04 0.98038079 8.27928372 1.53912813 0.48316988E-04 0.86500000E+04 0.98016982 8.39656537 1.53889974 0.64307787E-04 0.87000000E+04 0.97992392 8.51381280 1.53875243 0.84324509E-04 0.87500000E+04 0.97963869 8.63096539 1.53865414 0.10867293E-03 0.88000000E+04 0.97930942 8.74796302 1.53855294 0.13770653E-03 0.88500000E+04 0.97893109 8.86474666 1.53840963 0.17197430E-03 0.89000000E+04 0.97849843 8.98125899 1.53822122 0.21212967E-03 0.89500000E+04 0.97800596 9.09744477 1.53802070 0.25870036E-03 0.90000000E+04 0.97744799 9.21325092 1.53785380 0.31200414E-03 0.90500000E+04 0.97681868 9.32862644 1.53774863 0.37236389E-03 0.91000000E+04 0.97611203 9.44352232 1.53769767 0.44045502E-03 0.91500000E+04 0.97532195 9.55789155 1.53766326 0.51747866E-03 0.92000000E+04 0.97444223 9.67168931 1.53760296 0.60503227E-03 0.92500000E+04 0.97346653 9.78487302 1.53749755 0.70483534E-03 0.93000000E+04 0.97238837 9.89740231 1.53736298 0.81857892E-03 0.93500000E+04 0.97120110 10.00923869 1.53723836 0.94800805E-03 0.94000000E+04 0.96989780 10.12034501 1.53715863 0.10951094E-02 0.94500000E+04 0.96847132 10.23068484 1.53713042 0.12621676E-02 0.95000000E+04 0.96691409 10.34022199 1.53712752 0.14515732E-02 0.95500000E+04 0.96521818 10.44892010 1.53710883 0.16654680E-02 0.96000000E+04 0.96337515 10.55674234 1.53704687 0.19054180E-02 0.96500000E+04 0.96137598 10.66365112 1.53694686 0.21722808E-02 0.97000000E+04 0.95921110 10.76960778 1.53684311 0.24662665E-02 0.97500000E+04 0.95687025 10.87457221 1.53677502 0.27870710E-02 0.98000000E+04 0.95434250 10.97850261 1.53675961 0.31339239E-02 0.98500000E+04 0.95161624 11.08135534 1.53677927 0.35054885E-02 0.99000000E+04 0.94867921 11.18308505 1.53679357 0.38996662E-02 0.99500000E+04 0.94551853 11.28364489 1.53676709 0.43134380E-02 0.10000000E+05 0.94212082 11.38298699 1.53669388 0.47429012E-02 0.10050000E+05 0.93847229 11.48106286 1.53660125 0.51835489E-02 0.10100000E+05 0.93455893 11.57782395 1.53653024 0.56307631E-02 0.10150000E+05 0.93036664 11.67322232 1.53650689 0.60803888E-02 0.10200000E+05 0.92588153 11.76721134 1.53652450 0.65292294E-02 0.10250000E+05 0.92109008 11.85974658 1.53654938 0.69753460E-02 0.10300000E+05 0.91597946 11.95078676 1.53654560 0.74181497E-02 0.10350000E+05 0.91053784 12.04029473 1.53650102 0.78583378E-02 0.10400000E+05 0.90475465 12.12823848 1.53643515 0.82977822E-02 0.10450000E+05 0.89862093 12.21459209 1.53638338 0.87394538E-02 0.10500000E+05 0.89212965 12.29933660 1.53636953 0.91873757E-02 0.10550000E+05 0.88527594 12.38246084 1.53638738 0.96465630E-02 0.10600000E+05 0.87805738 12.46396217 1.53640509 0.10122888E-01 0.10650000E+05 0.87047416 12.54384692 1.53638997 0.10622803E-01 0.10700000E+05 0.86252919 12.62213070 1.53633506 0.11152891E-01 0.10750000E+05 0.85422816 12.69883839 1.53626699 0.11719285E-01 0.10800000E+05 0.84557949 12.77400391 1.53622768 0.12327041E-01 0.10850000E+05 0.83659427 12.84766975 1.53624246 0.12979571E-01 0.10900000E+05 0.82728605 12.91988640 1.53629819 0.13678211E-01 0.10950000E+05 0.81767073 12.99071166 1.53634876 0.14421925E-01 0.11000000E+05 0.80776629 13.06020990 1.53634597 0.15207088E-01 0.11050000E+05 0.79759255 13.12845130 1.53627518 0.16027382E-01 0.11100000E+05 0.78717086 13.19551094 1.53616944 0.16873828E-01 0.11150000E+05 0.77652380 13.26146786 1.53609008 0.17735066E-01 0.11200000E+05 0.76567472 13.32640391 1.53608554 0.18597930E-01 0.11250000E+05 0.75464731 13.39040236 1.53615672 0.19448308E-01 0.11300000E+05 0.74346505 13.45354634 1.53625370 0.20272180E-01 0.11350000E+05 0.73215058 13.51591697 1.53630762 0.21056634E-01 0.11400000E+05 0.72072522 13.57759136 1.53627682 0.21790681E-01 0.11450000E+05 0.70920835 13.63864067 1.53617568 0.22465749E-01 0.11500000E+05 0.69761700 13.69912827 1.53606527 0.23075896E-01 0.11550000E+05 0.68596558 13.75910833 1.53601190 0.23617818E-01 0.11600000E+05 0.67426579 13.81862500 1.53604235 0.24090720E-01 0.11650000E+05 0.66252668 13.87771231 1.53612683 0.24496082E-01 0.11700000E+05 0.65075501 13.93639475 1.53620121 0.24837247E-01 0.11750000E+05 0.63895564 13.99468860 1.53621246 0.25118780E-01 0.11800000E+05 0.62713213 14.05260384 1.53615503 0.25345589E-01 0.11850000E+05 0.61528733 14.11014628 1.53607224 0.25521960E-01 0.11900000E+05 0.60342395 14.16731987 1.53602230 0.25650812E-01 0.11950000E+05 0.59154508 14.22412885 1.53603486 0.25733405E-01 0.12000000E+05 0.57965456 14.28057956 1.53609024 0.25769546E-01 0.12050000E+05 0.56775722 14.33668169 1.53613626 0.25758097E-01 0.12100000E+05 0.55585902 14.39244913 1.53612965 0.25697490E-01 0.12150000E+05 0.54396699 14.44790011 1.53607063 0.25586072E-01 0.12200000E+05 0.53208921 14.50305696 1.53600394 0.25422349E-01 0.12250000E+05 0.52023460 14.55794548 1.53598435 0.25205394E-01 0.12300000E+05 0.50841280 14.61259411 1.53603255 0.24935523E-01 0.12350000E+05 0.49663403 14.66703291 1.53611562 0.24615101E-01 0.12400000E+05 0.48490889 14.72129261 1.53616824 0.24249059E-01 0.12450000E+05 0.47324823 14.77540362 1.53614070 0.23844759E-01 0.12500000E+05 0.46166296 14.82939506 1.53603909 0.23411147E-01 0.12550000E+05 0.45016387 14.88329371 1.53592654 0.22957425E-01 0.12600000E+05 0.43876136 14.93712297 1.53588147 0.22491681E-01 0.12650000E+05 0.42746517 14.99090169 1.53594113 0.22019964E-01 0.12700000E+05 0.41628421 15.04464304 1.53607135 0.21546022E-01 0.12750000E+05 0.40522630 15.09835346 1.53618602 0.21071640E-01 0.12800000E+05 0.39429816 15.15203184 1.53620444 0.20597205E-01 0.12850000E+05 0.38350539 15.20566911 1.53610784 0.20122112E-01 0.12900000E+05 0.37285264 15.25924838 1.53595460 0.19644780E-01 0.12950000E+05 0.36234381 15.31274562 1.53584204 0.19162323E-01 0.13000000E+05 0.35198238 15.36613108 1.53584028 0.18670256E-01 0.13050000E+05 0.34177162 15.41937110 1.53594532 0.18162692E-01 0.13100000E+05 0.33171485 15.47243029 1.53608356 0.17633275E-01 0.13150000E+05 0.32181551 15.52527375 1.53616389 0.17076602E-01 0.13200000E+05 0.31207724 15.57786902 1.53613972 0.16489522E-01 0.13250000E+05 0.30250377 15.63018756 1.53603717 0.15871708E-01 0.13300000E+05 0.29309884 15.68220550 1.53593020 0.15225269E-01 0.13350000E+05 0.28386601 15.73390390 1.53588354 0.14553645E-01 0.13400000E+05 0.27480853 15.78526825 1.53590806 0.13860433E-01 0.13450000E+05 0.26592922 15.83628773 1.53596177 0.13148798E-01 0.13500000E+05 0.25723036 15.88695423 1.53599190 0.12421745E-01 0.13550000E+05 0.24871366 15.93726132 1.53598176 0.11682978E-01 0.13600000E+05 0.24038025 15.98720331 1.53596256 0.10937712E-01 0.13650000E+05 0.23223066 16.03677431 1.53597913 0.10192835E-01 0.13700000E+05 0.22426484 16.08596734 1.53603841 0.94562601E-02 0.13750000E+05 0.21648224 16.13477346 1.53608893 0.87357676E-02 0.13800000E+05 0.20888184 16.18318099 1.53605683 0.80379797E-02 0.13850000E+05 0.20146228 16.23117478 1.53591531 0.73680227E-02 0.13900000E+05 0.19422193 16.27873600 1.53573046 0.67299916E-02 0.13950000E+05 0.18715903 16.32584220 1.53563605 0.61277986E-02 0.14000000E+05 0.18027176 16.37246809 1.53574021 0.55657453E-02 0.14050000E+05 0.17355838 16.41858676 1.53602619 0.50483634E-02 0.14100000E+05 0.16701727 16.46417133 1.53632904 0.45795652E-02 0.14150000E+05 0.16064703 16.50919665 1.53642549 0.41616130E-02 0.14200000E+05 0.15444643 16.55364081 1.53619078 0.37945562E-02 0.14250000E+05 0.14841448 16.59748627 1.53571545 0.34764957E-02 0.14300000E+05 0.14255032 16.64072033 1.53528528 0.32044997E-02 0.14350000E+05 0.13685326 16.68333492 1.53521172 0.29755879E-02 0.14400000E+05 0.13132263 16.72532581 1.53560998 0.27872101E-02 0.14450000E+05 0.12595780 16.76669113 1.53628054 0.26370369E-02 0.14500000E+05 0.12075804 16.80742933 1.53679913 0.25223492E-02 0.14550000E+05 0.11572254 16.84753667 1.53678186 0.24395544E-02 0.14600000E+05 0.11085030 16.88700428 1.53616148 0.23842304E-02 0.14650000E+05 0.10614011 16.92581517 1.53528071 0.23516990E-02 0.14700000E+05 0.10159045 16.96394127 1.53470949 0.23377515E-02 0.14750000E+05 0.09719950 17.00134099 1.53487601 0.23390536E-02 0.14800000E+05 0.09296506 17.03795750 1.53574997 0.23529993E-02 0.14850000E+05 0.08888458 17.07371780 1.53681065 0.23771805E-02 0.14900000E+05 0.08495515 17.10853278 1.53735404 0.24088923E-02 0.14950000E+05 0.08117362 17.14229803 1.53695906 0.24450401E-02 0.15000000E+05 0.07753657 17.17489534 1.53580545 0.24825123E-02 0.15050000E+05 0.07404042 17.20619477 1.53460833 0.25187530E-02 0.15100000E+05 0.07068150 17.23605713 1.53417568 0.25521424E-02 0.15150000E+05 0.06745603 17.26433673 1.53486114 0.25819485E-02 0.15200000E+05 0.06436022 17.29088433 1.53628498 0.26079162E-02 0.15250000E+05 0.06139027 17.31555022 1.53753815 0.26297923E-02 0.15300000E+05 0.05854239 17.33818735 1.53776342 0.26470869E-02 0.15350000E+05 0.05581289 17.35865453 1.53674179 0.26591695E-02 0.15400000E+05 0.05319818 17.37681977 1.53508407 0.26655606E-02 0.15450000E+05 0.05069477 17.39256382 1.53386934 0.26661617E-02 0.15500000E+05 0.04829930 17.40578373 1.53394118 0.26612526E-02 0.15550000E+05 0.04600856 17.41639661 1.53532240 0.26512767E-02 0.15600000E+05 0.04381945 17.42434328 1.53715365 0.26365995E-02 0.15650000E+05 0.04172902 17.42959193 1.53822628 0.26174335E-02 0.15700000E+05 0.03973448 17.43214173 1.53778132 0.25939733E-02 0.15750000E+05 0.03783316 17.43202643 1.53604687 0.25666077E-02 0.15800000E+05 0.03602253 17.42931776 1.53413287 0.25360080E-02 0.15850000E+05 0.03430017 17.42412846 1.53332226 0.25029874E-02 0.15900000E+05 0.03266376 17.41661452 1.53421179 0.24682076E-02 0.15950000E+05 0.03111101 17.40697625 1.53627596 0.24319333E-02 0.16000000E+05 0.02963964 17.39545796 1.53816838 0.23940207E-02 0.16050000E+05 0.02824739 17.38234622 1.53859738 0.23541689E-02 0.16100000E+05 0.02693192 17.36796681 1.53721165 0.23122772E-02 0.16150000E+05 0.02569087 17.35268059 1.53488503 0.22686735E-02 0.16200000E+05 0.02452181 17.33687829 1.53317148 0.22240570E-02 0.16250000E+05 0.02342222 17.32097418 1.53326946 0.21791898E-02 0.16300000E+05 0.02238954 17.30539860 1.53518346 0.21345414E-02 0.16350000E+05 0.02142107 17.29058937 1.53766445 0.20901156E-02 0.16400000E+05 0.02051408 17.27698218 1.53901461 0.20455645E-02 0.16450000E+05 0.01966577 17.26500052 1.53825237 0.20004957E-02 0.16500000E+05 0.01887325 17.25504550 1.53583588 0.19547619E-02 0.16550000E+05 0.01813363 17.24748598 1.53340209 0.19085551E-02 0.16600000E+05 0.01744395 17.24264925 1.53266037 0.18622774E-02 0.16650000E+05 0.01680127 17.24081280 1.53418920 0.18163070E-02 0.16700000E+05 0.01620261 17.24219723 1.53697993 0.17708275E-02 0.16750000E+05 0.01564503 17.24696110 1.53908750 0.17258202E-02 0.16800000E+05 0.01512564 17.25519790 1.53898574 0.16811892E-02 0.16850000E+05 0.01464157 17.26693548 1.53668503 0.16369015E-02 0.16900000E+05 0.01419005 17.28213803 1.53377981 0.15930301E-02 0.16950000E+05 0.01376839 17.30071027 1.53234531 0.15496887E-02 0.17000000E+05 0.01337400 17.32250340 1.53344982 0.15069368E-02 0.17050000E+05 0.01300442 17.34732247 1.53635108 0.14647536E-02 0.17100000E+05 0.01265728 17.37493470 1.53898263 0.14231049E-02 0.17150000E+05 0.01233039 17.40507828 1.53942368 0.13820370E-02 0.17200000E+05 0.01202168 17.43747139 1.53731015 0.13417080E-02 0.17250000E+05 0.01172924 17.47182091 1.53414021 0.13023172E-02 0.17300000E+05 0.01145130 17.50783024 1.53221373 0.12639841E-02 0.17350000E+05 0.01118625 17.54520611 1.53295804 0.12266725E-02 0.17400000E+05 0.01093263 17.58366415 1.53586184 0.11902222E-02 0.17450000E+05 0.01068910 17.62293322 1.53881690 0.11544654E-02 0.17500000E+05 0.01045449 17.66275894 1.53964739 0.11193450E-02 0.17550000E+05 0.01022775 17.70290635 1.53771863 0.10849481E-02 0.17600000E+05 0.01000794 17.74316189 1.53442845 0.10514389E-02 0.17650000E+05 0.00979427 17.78333455 1.53219602 0.10189435E-02 0.17700000E+05 0.00958604 17.82325615 1.53267942 0.98747149E-03 0.17750000E+05 0.00938265 17.86278086 1.53553513 0.95692521E-03 0.17800000E+05 0.00918360 17.90178417 1.53865184 0.92717810E-03 0.17850000E+05 0.00898847 17.94016157 1.53971025 0.89815793E-03 0.17900000E+05 0.00879690 17.97782707 1.53791677 0.86987341E-03 0.17950000E+05 0.00860862 18.01471172 1.53460536 0.84237499E-03 0.18000000E+05 0.00842340 18.05076205 1.53224675 0.81569269E-03 0.18050000E+05 0.00824104 18.08593838 1.53260326 0.78980473E-03 0.18100000E+05 0.00806143 18.12021307 1.53540460 0.76465778E-03 0.18150000E+05 0.00788445 18.15356886 1.53854051 0.74021336E-03 0.18200000E+05 0.00771003 18.18599742 1.53964689 0.71647484E-03 0.18250000E+05 0.00753811 18.21749798 1.53789755 0.69347149E-03 0.18300000E+05 0.00736867 18.24807618 1.53463027 0.67121535E-03 0.18350000E+05 0.00720168 18.27774282 1.53232425 0.64967081E-03 0.18400000E+05 0.00703713 18.30651264 1.53271648 0.62876407E-03 0.18450000E+05 0.00687503 18.33440324 1.53548911 0.60842536E-03 0.18500000E+05 0.00671538 18.36143410 1.53851489 0.58863055E-03 0.18550000E+05 0.00655818 18.38762601 1.53948250 0.56940914E-03 0.18600000E+05 0.00640346 18.41300065 1.53767128 0.55081301E-03 0.18650000E+05 0.00625121 18.43758023 1.53449956 0.53287016E-03 0.18700000E+05 0.00610144 18.46138724 1.53241472 0.51555770E-03 0.18750000E+05 0.00595418 18.48444405 1.53299945 0.49881140E-03 0.18800000E+05 0.00580942 18.50677262 1.53576762 0.48256155E-03 0.18850000E+05 0.00566718 18.52839432 1.53855966 0.46676777E-03 0.18900000E+05 0.00552745 18.54932985 1.53921979 0.45143057E-03 0.18950000E+05 0.00539024 18.56959921 1.53726679 0.43657523E-03 0.19000000E+05 0.00525556 18.58922176 1.53425625 0.42222316E-03 0.19050000E+05 0.00512340 18.60821623 1.53254367 0.40837172E-03 0.19100000E+05 0.00499375 18.62660066 1.53343403 0.39499452E-03 0.19150000E+05 0.00486661 18.64439255 1.53618439 0.38205786E-03 0.19200000E+05 0.00474198 18.66160895 1.53861918 0.36953737E-03 0.19250000E+05 0.00461985 18.67826657 1.53884588 0.35742230E-03 0.19300000E+05 0.00450021 18.69438191 1.53672919 0.34570681E-03 0.19350000E+05 0.00438304 18.70997124 1.53397495 0.33437902E-03 0.19400000E+05 0.00426833 18.72505056 1.53275857 0.32341901E-03 0.19450000E+05 0.00415606 18.73963561 1.53399941 0.31280742E-03 0.19500000E+05 0.00404623 18.75374184 1.53666291 0.30253631E-03 0.19550000E+05 0.00393881 18.76738447 1.53862075 0.29261127E-03 0.19600000E+05 0.00383379 18.78057848 1.53834912 0.28304135E-03 0.19650000E+05 0.00373113 18.79333859 1.53611649 0.27382397E-03 0.19700000E+05 0.00363082 18.80567924 1.53373768 0.26493664E-03 0.19750000E+05 0.00353282 18.81761454 1.53310166 0.25634326E-03 0.19800000E+05 0.00343713 18.82915827 1.53466483 0.24801125E-03 0.19850000E+05 0.00334370 18.84032387 1.53712388 0.23992702E-03 0.19900000E+05 0.00325252 18.85112438 1.53850100 0.23209771E-03 0.19950000E+05 0.00316354 18.86157242 1.53773295 0.22453802E-03 0.20000000E+05 0.00307673 18.87168009 1.53549277 0.21725283E-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 -0.015149 1.22376 2 0.1554312 -0.019549 0.65525 3 0.1597487 -0.011619 0.10595 4 0.1640662 0.001743 -0.44167 5 0.1683837 0.011255 -1.00332 6 0.1727013 0.011326 -1.58170 7 0.1770188 0.003418 -2.15833 8 0.1813363 -0.005624 -2.70692 9 0.1856539 -0.008971 3.06517 10 0.1899714 -0.004815 2.57991 11 0.1942889 0.002726 2.10222 12 0.1986065 0.007317 1.62359 13 0.2029240 0.005574 1.15409 14 0.2072415 -0.000455 0.71285 15 0.2115591 -0.005393 0.30808 16 0.2158766 -0.005216 -0.06867 17 0.2201941 -0.000515 -0.43264 18 0.2245117 0.004302 -0.79356 19 0.2288292 0.004999 -1.14875 20 0.2331467 0.001191 -1.48746 21 0.2374643 -0.003420 -1.80370 22 0.2417818 -0.004475 -2.10311 23 0.2460993 -0.001072 -2.39802 24 0.2504169 0.003285 -2.69683 25 0.2547344 0.004102 -2.99641 26 0.2590519 0.000593 2.99692 27 0.2633695 -0.003310 2.72116 28 0.2676870 -0.003192 2.45131 29 0.2720045 0.000697 2.17488 30 0.2763221 0.003567 1.88957 31 0.2806396 0.001872 1.60777 32 0.2849571 -0.002128 1.34115 33 0.2892746 -0.003165 1.08517 34 0.2935922 0.000061 0.82590 35 0.2979097 0.003017 0.56008 36 0.3022272 0.001561 0.30255 37 0.3065448 -0.002152 0.06648 38 0.3108623 -0.002687 -0.15501 39 0.3151798 0.000709 -0.37832 40 0.3194974 0.002906 -0.60621 41 0.3238149 0.000590 -0.82296 42 0.3281324 -0.002628 -1.01853 43 0.3324500 -0.001746 -1.20472 44 0.3367675 0.001783 -1.39928 45 0.3410850 0.002329 -1.60056 46 0.3454026 -0.000893 -1.78907 47 0.3497201 -0.002558 -1.95930 48 0.3540376 0.000030 -2.13001 49 0.3583552 0.002514 -2.31687 50 0.3626727 0.000817 -2.50605 51 0.3669902 -0.001987 -2.67474 52 0.3713078 -0.000989 -2.83019 53 0.3756253 0.002119 -2.99854 54 0.3799428 0.002080 3.10208 55 0.3842604 -0.000686 2.93567 56 0.3885779 -0.000898 2.79515 57 0.3928954 0.002162 2.65254 58 0.3972129 0.003478 2.48926 59 0.4015305 0.001444 2.33157 60 0.4058480 0.000710 2.20533 61 0.4101655 0.003627 2.08844 62 0.4144831 0.006075 1.94832 63 0.4188006 0.005270 1.80009 64 0.4231181 0.004899 1.68232 65 0.4274357 0.008140 1.58393 66 0.4317532 0.011886 1.46340 67 0.4360707 0.012896 1.32309 68 0.4403883 0.013942 1.21001 69 0.4447058 0.018447 1.12543 70 0.4490233 0.024188 1.02326 71 0.4533409 0.027897 0.89484 72 0.4576584 0.031479 0.79068 73 0.4619759 0.038238 0.72270 74 0.4662935 0.046900 0.64577 75 0.4706110 0.054456 0.54573 76 0.4749285 0.061559 0.47060 77 0.4792461 0.070718 0.43572 78 0.4835636 0.081809 0.39439 79 0.4878811 0.092909 0.32027 80 0.4921987 0.103666 0.25674 81 0.4965162 0.115372 0.23148 82 0.5008337 0.128588 0.20227 83 0.5051512 0.142044 0.13599 84 0.5094688 0.154334 0.07528 85 0.5137863 0.166434 0.05475 86 0.5181038 0.180341 0.03081 87 0.5224214 0.194627 -0.03352 88 0.5267389 0.205841 -0.08936 89 0.5310564 0.215397 -0.09839 90 0.5353740 0.227765 -0.11200 91 0.5396915 0.240987 -0.17271 92 0.5440090 0.249482 -0.22417 93 0.5483266 0.255959 -0.22589 ******************************************************************************** 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 0.1000317E+01 0.1995813E-01 0.4950105E+00 1 0.3643874E-06 0.3841808E-01 0.9052158E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.7609593E-07 0 31 2 -2 0.1973972E-07 0 37 2 -1 0.2531727E-07 0 44 2 0 0.5831027E-07 0 50 2 1 0.1792196E-06 0 56 2 2 0.4962833E-06 0 21 4 -4 0.1612979E-08 0 26 4 -3 0.1842705E-08 0 32 4 -2 0.3585189E-08 0 38 4 -1 0.1861528E-07 0 45 4 0 0.3787677E-07 0 51 4 1 0.2229524E-06 0 57 4 2 0.3696109E-06 0 62 4 3 0.9226396E-06 0 67 4 4 0.2256171E-05 0 13 6 -6 0.6066246E-10 0 17 6 -5 0.2857446E-10 0 22 6 -4 0.8040020E-10 0 27 6 -3 0.3406228E-09 0 33 6 -2 0.1228692E-08 0 39 6 -1 0.7756316E-08 0 46 6 0 0.2208887E-07 0 52 6 1 0.2060520E-06 0 58 6 2 0.7284823E-06 0 63 6 3 0.4355996E-05 0 68 6 4 0.8652728E-05 0 72 6 5 0.1953387E-04 0 76 6 6 0.1598854E-04 0 7 8 -8 0.8406625E-11 0 10 8 -7 0.4111104E-11 0 14 8 -6 0.2137023E-11 0 18 8 -5 0.2228228E-11 0 23 8 -4 0.2366552E-11 0 28 8 -3 0.9128181E-11 0 34 8 -2 0.7630026E-10 0 40 8 -1 0.9741974E-09 0 47 8 0 0.6703011E-08 0 53 8 1 0.7927478E-07 0 59 8 2 0.2759093E-06 0 64 8 3 0.7021289E-05 0 69 8 4 0.1290852E-03 0 73 8 5 0.4190174E-02 0 77 8 6 0.8152899E-01 0 80 8 7 0.8344247E+00 0 83 8 8 0.7998276E-01 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 0.7692830E-08 1 31 2 -2 0.8215238E-10 1 37 2 -1 0.1387122E-09 1 44 2 0 0.2780278E-08 1 50 2 1 0.6785540E-07 1 56 2 2 0.1094681E-06 1 21 4 -4 0.4354781E-12 1 26 4 -3 0.7654618E-12 1 32 4 -2 0.8037759E-12 1 38 4 -1 0.2516451E-10 1 45 4 0 0.2065212E-08 1 51 4 1 0.6839621E-07 1 57 4 2 0.5477904E-08 1 62 4 3 0.2828025E-07 1 67 4 4 0.7212324E-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 0.3985189E-15 1 0.2025369E-08 2 0.3508153E-08 3 0.1470651E-08 4 0.4127825E-08 5 0.6095755E-08 6 0.2233736E-07 7 0.1610653E-07 8 0.1549293E-07 9 0.4931364E-08 v, j, mj = 0 2 -2 0 0.4521088E-09 1 0.1090122E-08 2 0.8287711E-09 3 0.1423804E-08 4 0.2269406E-08 5 0.1748811E-08 6 0.1885813E-08 7 0.2440157E-08 8 0.3953888E-08 9 0.3646837E-08 v, j, mj = 0 2 -1 0 0.2332541E-15 1 0.1686390E-08 2 0.5549962E-09 3 0.1652741E-08 4 0.3085584E-08 5 0.3167209E-08 6 0.3827742E-08 7 0.6667945E-08 8 0.3066941E-08 9 0.1607727E-08 v, j, mj = 0 2 0 0 0.1848494E-15 1 0.8698778E-09 2 0.2122387E-08 3 0.8328100E-08 4 0.8225778E-08 5 0.8049069E-08 6 0.1022039E-07 7 0.9655668E-08 8 0.6482344E-08 9 0.4356656E-08 v, j, mj = 0 2 1 0 0.6839025E-09 1 0.8004788E-08 2 0.4552767E-07 3 0.2291324E-07 4 0.2480354E-07 5 0.1859325E-07 6 0.2783083E-07 7 0.1844499E-07 8 0.8725993E-08 9 0.3691383E-08 v, j, mj = 0 2 2 0 0.9987506E-17 1 0.8993194E-08 2 0.4248080E-07 3 0.4131463E-07 4 0.6568126E-07 5 0.1623186E-06 6 0.8787904E-07 7 0.6230972E-07 8 0.2107946E-07 9 0.4226523E-08 v, j, mj = 0 4 -4 0 0.3868605E-15 1 0.6782177E-10 2 0.1227492E-09 3 0.1387124E-09 4 0.1435451E-09 5 0.6444721E-10 6 0.1622289E-09 7 0.3003409E-09 8 0.4424587E-09 9 0.1706743E-09 v, j, mj = 0 4 -3 0 0.5672230E-15 1 0.1396133E-09 2 0.2658508E-09 3 0.2308095E-09 4 0.8853995E-10 5 0.2024854E-09 6 0.1479939E-09 7 0.2151719E-09 8 0.3374784E-09 9 0.2147614E-09 v, j, mj = 0 4 -2 0 0.9139520E-11 1 0.1739588E-09 2 0.8380231E-10 3 0.4509789E-09 4 0.4620280E-09 5 0.6647977E-09 6 0.6462303E-09 7 0.5197900E-09 8 0.3726498E-09 9 0.2018132E-09 v, j, mj = 0 4 -1 0 0.1381787E-15 1 0.2855328E-08 2 0.1007570E-08 3 0.9039518E-09 4 0.1736583E-08 5 0.2615204E-08 6 0.2194958E-08 7 0.3297557E-08 8 0.2426666E-08 9 0.1577462E-08 v, j, mj = 0 4 0 0 0.2011221E-15 1 0.5526737E-08 2 0.9925362E-08 3 0.4538457E-08 4 0.5596040E-08 5 0.4947375E-08 6 0.2149523E-08 7 0.2812440E-08 8 0.1491911E-08 9 0.8889223E-09 v, j, mj = 0 4 1 0 0.1394349E-08 1 0.5464605E-07 2 0.2010648E-07 3 0.2256787E-07 4 0.2542420E-07 5 0.3352484E-07 6 0.3425855E-07 7 0.2107095E-07 8 0.7013316E-08 9 0.2945810E-08 v, j, mj = 0 4 2 0 0.3898741E-15 1 0.1029559E-07 2 0.9505782E-07 3 0.6927224E-07 4 0.7909397E-07 5 0.4903699E-07 6 0.3449234E-07 7 0.2709452E-07 8 0.3795814E-08 9 0.1471604E-08 v, j, mj = 0 4 3 0 0.4200772E-15 1 0.6610198E-07 2 0.1877241E-06 3 0.4143126E-07 4 0.1518534E-06 5 0.1145566E-06 6 0.1924411E-06 7 0.1638514E-06 8 0.3653702E-08 9 0.1025952E-08 v, j, mj = 0 4 4 0 0.1263565E-07 1 0.8675968E-07 2 0.2076104E-06 3 0.5999007E-06 4 0.4165228E-06 5 0.4444174E-06 6 0.3782725E-06 7 0.1035535E-06 8 0.4334700E-08 9 0.2163645E-08 v, j, mj = 0 6 -6 0 0.2358978E-14 1 0.8155091E-13 2 0.3731192E-12 3 0.1978190E-11 4 0.5368060E-11 5 0.1034066E-10 6 0.1932748E-10 7 0.2212899E-10 8 0.1062048E-11 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.2649450E-13 1 0.6752056E-12 2 0.8896193E-12 3 0.1036776E-11 4 0.8460254E-12 5 0.3940737E-11 6 0.4234633E-11 7 0.1626529E-10 8 0.6596810E-12 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.3768581E-15 1 0.5451579E-12 2 0.4720729E-12 3 0.4778604E-11 4 0.5609162E-11 5 0.9797585E-11 6 0.2346502E-10 7 0.3291618E-10 8 0.2816036E-11 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.3518204E-15 1 0.1259999E-11 2 0.7795998E-11 3 0.1147684E-10 4 0.2136622E-10 5 0.3435027E-10 6 0.7974142E-10 7 0.1823041E-09 8 0.2327636E-11 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.7227819E-11 1 0.4851132E-10 2 0.4618816E-10 3 0.3659690E-10 4 0.1010569E-09 5 0.1327339E-09 6 0.3528347E-09 7 0.4995636E-09 8 0.3979160E-11 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.8989645E-17 1 0.2199027E-09 2 0.6185806E-09 3 0.4001680E-09 4 0.1213533E-08 5 0.9061929E-09 6 0.1914630E-08 7 0.2472891E-08 8 0.1041913E-10 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.4697171E-17 1 0.2631960E-08 2 0.2563182E-08 3 0.3716146E-08 4 0.8897235E-09 5 0.2482356E-08 6 0.5706157E-08 7 0.4037514E-08 8 0.6182695E-10 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.2665449E-08 1 0.2704108E-07 2 0.3177630E-07 3 0.1679336E-07 4 0.5827360E-07 5 0.1991224E-07 6 0.3281027E-07 7 0.1669190E-07 8 0.8780627E-10 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.3418346E-15 1 0.1635236E-06 2 0.1094575E-06 3 0.1834729E-06 4 0.1367686E-06 5 0.5745367E-07 6 0.6765363E-07 7 0.9918164E-08 8 0.2343243E-09 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.7275723E-14 1 0.4076338E-06 2 0.9090072E-06 3 0.1358787E-05 4 0.1097219E-05 5 0.3213524E-06 6 0.2041580E-06 7 0.5750552E-07 8 0.3327103E-09 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.1872104E-07 1 0.2552071E-05 2 0.2493967E-05 3 0.2123635E-05 4 0.9976154E-06 5 0.2624677E-06 6 0.1797742E-06 7 0.2396355E-07 8 0.5129453E-09 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.2211620E-13 1 0.8436237E-05 2 0.1587518E-05 3 0.1641865E-05 4 0.5084726E-05 5 0.2584700E-05 6 0.1450883E-06 7 0.5298703E-07 8 0.7475185E-09 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.1242909E-14 1 0.1808229E-06 2 0.6772970E-05 3 0.5298879E-05 4 0.2063449E-05 5 0.1547547E-05 6 0.1053688E-06 7 0.1848967E-07 8 0.1009350E-08 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.6056562E-15 1 0.7404292E-14 2 0.1825758E-12 3 0.1248821E-11 4 0.3932990E-11 5 0.3034228E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.6631511E-16 1 0.4963858E-14 2 0.1264356E-12 3 0.6074764E-12 4 0.1258266E-11 5 0.2113896E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.3168354E-16 1 0.7981320E-14 2 0.2941321E-13 3 0.8005215E-13 4 0.8255112E-12 5 0.1194033E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.5854342E-14 1 0.6508142E-13 2 0.1129005E-12 3 0.2095150E-12 4 0.8025581E-12 5 0.1032319E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.4180467E-17 1 0.1890235E-13 2 0.1738563E-12 3 0.4850580E-12 4 0.1191410E-11 5 0.4973205E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.1867274E-17 1 0.5342130E-13 2 0.3190534E-13 3 0.7282291E-12 4 0.6025363E-11 5 0.2289261E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.6202147E-12 1 0.2847968E-12 2 0.1452899E-11 3 0.2564768E-11 4 0.2615155E-10 5 0.4522603E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.1560956E-18 1 0.1522395E-10 2 0.2595467E-10 3 0.3514754E-10 4 0.6276020E-09 5 0.2702693E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.4992898E-19 1 0.5435912E-09 2 0.5687605E-09 3 0.1319111E-08 4 0.1035108E-08 5 0.3236440E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.2846760E-08 1 0.6836475E-08 2 0.1455715E-07 3 0.1185236E-07 4 0.2633432E-07 5 0.1684771E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.8550204E-18 1 0.4241713E-07 2 0.6970975E-07 3 0.5913908E-07 4 0.4740217E-07 5 0.5724121E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.3973710E-16 1 0.1127263E-05 2 0.3034864E-05 3 0.2102445E-05 4 0.4774193E-06 5 0.2792975E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.2867902E-06 1 0.6285398E-05 2 0.7643780E-04 3 0.4442518E-04 4 0.1506066E-05 5 0.1439291E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.2488117E-15 1 0.2526267E-03 2 0.2990819E-02 3 0.9114061E-03 4 0.3505500E-04 5 0.2666823E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1154697E-16 1 0.1818964E-01 2 0.5304286E-01 3 0.1008797E-01 4 0.2080593E-03 5 0.4664452E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1660767E+00 1 0.2440371E+00 2 0.3852993E+00 3 0.3853271E-01 4 0.4777038E-03 5 0.1121406E-05 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.4356560E-16 1 0.5048275E-02 2 0.5805197E-01 3 0.1648881E-01 4 0.3931388E-03 5 0.5597908E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.7120286E-16 1 0.3506483E-08 2 0.1130826E-08 3 0.3506853E-09 4 0.6418109E-09 5 0.2063025E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.3549054E-12 1 0.2581252E-12 2 0.7378388E-12 3 0.1161583E-10 4 0.6918568E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.1437751E-16 1 0.1876323E-10 2 0.2416403E-10 3 0.3066866E-10 4 0.6511628E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.2888155E-16 1 0.2714415E-09 2 0.9766347E-10 3 0.2569714E-09 4 0.2154202E-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 0.3877047E-07 1 0.6323234E-08 2 0.1489339E-07 3 0.3177382E-08 4 0.4690927E-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 0.1037438E-16 1 0.6561752E-08 2 0.1598672E-07 3 0.1116620E-07 4 0.7575340E-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 4 -4 0 0.6944416E-18 1 0.1586806E-12 2 0.2767968E-12 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.3569128E-19 1 0.1994757E-12 2 0.5659860E-12 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.2646840E-13 1 0.1245865E-12 2 0.6527210E-12 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.1196254E-17 1 0.2482344E-11 2 0.2268216E-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 4 0 0 0.2795565E-18 1 0.8160801E-09 2 0.1249132E-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 1 0 0.1343576E-07 1 0.3848225E-07 2 0.1647819E-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 0.1202861E-19 1 0.4848301E-08 2 0.6296031E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.5365565E-19 1 0.3535053E-08 2 0.2474520E-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 0.4225923E-09 1 0.4574297E-07 2 0.2595768E-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 sum of the probabilities = 1.0003176 average vibrational energy (ev) = 0.000000 average rotational energy (ev) = 0.495010 average diffraction energy (ev) = 0.019958 the reaction probability = -0.3176469D-03 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.41272524D+01 trans energy = 0.26428571D+00 trans energy in z = 0.26428571D+00 total momentum = 0.84480953D+01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.1003283E+01 0.3123139E-01 0.4949914E+00 1 0.1659163E-05 0.3035517E-01 0.1160029E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.1101083E-06 0 31 2 -2 0.3218019E-07 0 37 2 -1 0.5174358E-07 0 44 2 0 0.6758038E-07 0 50 2 1 0.2192174E-06 0 56 2 2 0.5976625E-06 0 21 4 -4 0.6130398E-08 0 26 4 -3 0.5659903E-08 0 32 4 -2 0.7694319E-08 0 38 4 -1 0.3298062E-07 0 45 4 0 0.1034919E-06 0 51 4 1 0.3208663E-06 0 57 4 2 0.6655102E-06 0 62 4 3 0.2290208E-05 0 67 4 4 0.2876550E-05 0 13 6 -6 0.1676396E-09 0 17 6 -5 0.9722595E-10 0 22 6 -4 0.1966116E-09 0 27 6 -3 0.7735922E-09 0 33 6 -2 0.2403745E-08 0 39 6 -1 0.1301431E-07 0 46 6 0 0.5578241E-07 0 52 6 1 0.4755905E-06 0 58 6 2 0.3152712E-05 0 63 6 3 0.1232826E-04 0 68 6 4 0.3201655E-04 0 72 6 5 0.4492569E-04 0 76 6 6 0.4918896E-04 0 7 8 -8 0.2346634E-10 0 10 8 -7 0.1477988E-10 0 14 8 -6 0.8147650E-11 0 18 8 -5 0.6282345E-11 0 23 8 -4 0.1773795E-10 0 28 8 -3 0.4030995E-10 0 34 8 -2 0.3181231E-09 0 40 8 -1 0.1832867E-08 0 47 8 0 0.1848473E-07 0 53 8 1 0.1225812E-06 0 59 8 2 0.9539847E-06 0 64 8 3 0.2450183E-04 0 69 8 4 0.6528057E-03 0 73 8 5 0.1365380E-01 0 77 8 6 0.1387797E+00 0 80 8 7 0.6513232E+00 0 83 8 8 0.1986971E+00 0 3 10 -10 0.1514190E-13 0 5 10 -9 0.9950048E-13 0 8 10 -8 0.2723478E-14 0 11 10 -7 0.1358880E-14 0 15 10 -6 0.1125576E-14 0 19 10 -5 0.8462217E-14 0 24 10 -4 0.8298991E-14 0 29 10 -3 0.4478011E-14 0 35 10 -2 0.7653976E-13 0 41 10 -1 0.4069698E-12 0 48 10 0 0.3799362E-11 0 54 10 1 0.9265216E-10 0 60 10 2 0.4661041E-10 0 65 10 3 0.5058855E-09 0 70 10 4 0.1160072E-08 0 74 10 5 0.3845191E-07 0 78 10 6 0.8656072E-07 0 81 10 7 0.4294242E-06 0 84 10 8 0.4801461E-06 0 86 10 9 0.2782496E-06 0 88 10 10 0.4578193E-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 0.1469624E-07 1 31 2 -2 0.4635971E-09 1 37 2 -1 0.8913434E-09 1 44 2 0 0.1135145E-07 1 50 2 1 0.1919094E-06 1 56 2 2 0.2206608E-06 1 21 4 -4 0.2666284E-11 1 26 4 -3 0.5171300E-11 1 32 4 -2 0.1741984E-10 1 38 4 -1 0.3027643E-09 1 45 4 0 0.8252348E-08 1 51 4 1 0.3137829E-07 1 57 4 2 0.2885937E-07 1 62 4 3 0.7356126E-06 1 67 4 4 0.4147594E-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 0.7423589E-14 1 0.1461927E-08 2 0.4544597E-08 3 0.4750881E-08 4 0.1775725E-07 5 0.1042055E-07 6 0.2075054E-07 7 0.3000077E-07 8 0.1470747E-07 9 0.5714342E-08 v, j, mj = 0 2 -2 0 0.9148786E-09 1 0.2630543E-08 2 0.1641741E-08 3 0.2298450E-08 4 0.6219737E-08 5 0.4779852E-08 6 0.3992089E-08 7 0.2181598E-08 8 0.3194062E-08 9 0.4327236E-08 v, j, mj = 0 2 -1 0 0.9603636E-15 1 0.3108976E-08 2 0.5458358E-08 3 0.3251901E-08 4 0.9244647E-08 5 0.6773925E-08 6 0.7905556E-08 7 0.1230248E-07 8 0.2776700E-08 9 0.9210386E-09 v, j, mj = 0 2 0 0 0.1132754E-14 1 0.1146646E-08 2 0.3729218E-08 3 0.8646702E-08 4 0.6165330E-08 5 0.1213045E-07 6 0.1001398E-07 7 0.1514880E-07 8 0.6651034E-08 9 0.3948220E-08 v, j, mj = 0 2 1 0 0.3413015E-09 1 0.9662554E-08 2 0.3822482E-07 3 0.3434153E-07 4 0.2876285E-07 5 0.2625211E-07 6 0.4344001E-07 7 0.2838434E-07 8 0.8128668E-08 9 0.1679214E-08 v, j, mj = 0 2 2 0 0.1081730E-14 1 0.5149489E-08 2 0.5178256E-07 3 0.3969072E-07 4 0.5600692E-07 5 0.8918143E-07 6 0.1984099E-06 7 0.1298825E-06 8 0.1997311E-07 9 0.7585803E-08 v, j, mj = 0 4 -4 0 0.7643640E-14 1 0.3334085E-09 2 0.1243824E-08 3 0.1427990E-08 4 0.1269183E-08 5 0.7783657E-09 6 0.1535085E-09 7 0.1927163E-09 8 0.3052901E-09 9 0.4261041E-09 v, j, mj = 0 4 -3 0 0.6410528E-14 1 0.1154806E-08 2 0.7874757E-09 3 0.5182438E-09 4 0.4959016E-09 5 0.4196506E-09 6 0.5932713E-09 7 0.7279442E-09 8 0.6023577E-09 9 0.3602454E-09 v, j, mj = 0 4 -2 0 0.2993734E-10 1 0.5689230E-09 2 0.7695092E-09 3 0.1030987E-08 4 0.8045566E-09 5 0.1251739E-08 6 0.1542712E-08 7 0.1073252E-08 8 0.3175831E-09 9 0.3051192E-09 v, j, mj = 0 4 -1 0 0.1094483E-14 1 0.6535627E-08 2 0.4918409E-09 3 0.3678409E-08 4 0.6457310E-08 5 0.1766010E-08 6 0.5012512E-08 7 0.4580728E-08 8 0.2448548E-08 9 0.2009635E-08 v, j, mj = 0 4 0 0 0.1447891E-14 1 0.9819104E-08 2 0.1265286E-07 3 0.3476959E-07 4 0.2175385E-07 5 0.9399145E-08 6 0.7004880E-08 7 0.5794421E-08 8 0.1687184E-08 9 0.6108814E-09 v, j, mj = 0 4 1 0 0.1413324E-08 1 0.9996171E-08 2 0.5800945E-07 3 0.1128471E-06 4 0.5231990E-07 5 0.2366642E-07 6 0.2034230E-07 7 0.3118867E-07 8 0.8074823E-08 9 0.3008113E-08 v, j, mj = 0 4 2 0 0.1471188E-14 1 0.3330650E-07 2 0.2019413E-06 3 0.1657422E-06 4 0.3801030E-07 5 0.8328886E-07 6 0.6361528E-07 7 0.6859670E-07 8 0.9430112E-08 9 0.1579020E-08 v, j, mj = 0 4 3 0 0.5994538E-14 1 0.1989576E-06 2 0.4634174E-06 3 0.2179340E-06 4 0.3715290E-06 5 0.3503237E-06 6 0.4724779E-06 7 0.2001872E-06 8 0.1277121E-07 9 0.2610395E-08 v, j, mj = 0 4 4 0 0.2310462E-07 1 0.7151631E-07 2 0.4402640E-06 3 0.3413852E-06 4 0.6945595E-06 5 0.7403225E-06 6 0.4101683E-06 7 0.1154860E-06 8 0.3322762E-07 9 0.6515859E-08 v, j, mj = 0 6 -6 0 0.5925322E-13 1 0.2406650E-11 2 0.1065273E-10 3 0.4283695E-11 4 0.1047919E-10 5 0.6584160E-11 6 0.1507048E-10 7 0.4641590E-10 8 0.7168757E-10 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.2845093E-11 1 0.3127799E-12 2 0.3520897E-11 3 0.7541997E-11 4 0.1017615E-10 5 0.7001979E-11 6 0.2428182E-10 7 0.2517425E-10 8 0.1637099E-10 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.3426402E-14 1 0.6527154E-12 2 0.1246084E-10 3 0.1327455E-10 4 0.1610566E-10 5 0.2082724E-10 6 0.4082378E-10 7 0.6580326E-10 8 0.2666011E-10 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.4018011E-14 1 0.2414638E-10 2 0.5340533E-10 3 0.2002692E-10 4 0.9905867E-10 5 0.9908470E-10 6 0.2000093E-09 7 0.2059681E-09 8 0.7188869E-10 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.2827358E-10 1 0.4514111E-10 2 0.1120669E-09 3 0.1192738E-09 4 0.1612299E-09 5 0.4408473E-09 6 0.5181128E-09 7 0.2898841E-09 8 0.6889157E-09 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.2666750E-15 1 0.1367677E-08 2 0.1378801E-08 3 0.1010034E-08 4 0.2015166E-08 5 0.1620076E-08 6 0.2079632E-08 7 0.2354832E-08 8 0.1188093E-08 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.3202574E-16 1 0.6842123E-08 2 0.8014406E-08 3 0.1671939E-07 4 0.6382544E-08 5 0.4256916E-08 6 0.6557898E-08 7 0.2409194E-08 8 0.4599938E-08 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.2575826E-07 1 0.2141928E-07 2 0.7799141E-07 3 0.1519609E-06 4 0.1343969E-06 5 0.2763859E-07 6 0.2053546E-07 7 0.9988925E-08 8 0.5900784E-08 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.4416557E-14 1 0.2263737E-06 2 0.6777004E-06 3 0.1442033E-05 4 0.6138043E-06 5 0.7504227E-07 6 0.7752260E-07 7 0.3193406E-07 8 0.8301813E-08 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.8155595E-13 1 0.3851028E-06 2 0.4464523E-05 3 0.5719015E-05 4 0.1368042E-05 5 0.2410393E-06 6 0.1121840E-06 7 0.3546469E-07 8 0.2888275E-08 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.1022255E-06 1 0.6711739E-05 2 0.1401553E-04 3 0.8377639E-05 4 0.1978494E-05 5 0.4577736E-06 6 0.2921390E-06 7 0.6792270E-07 8 0.1309111E-07 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.3282956E-12 1 0.3080378E-04 2 0.3805134E-05 3 0.3126523E-05 4 0.4981602E-05 5 0.1919382E-05 6 0.1760439E-06 7 0.8956318E-07 8 0.2365889E-07 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.2895549E-13 1 0.5924055E-05 2 0.1455096E-04 3 0.9901796E-05 4 0.9386832E-05 5 0.8101833E-05 6 0.1272822E-05 7 0.2610720E-07 8 0.2455210E-07 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.1340573E-13 1 0.1254772E-12 2 0.1068662E-11 3 0.2247948E-11 4 0.4413581E-11 5 0.6970645E-11 6 0.8626625E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1037454E-13 1 0.2702589E-12 2 0.1185414E-11 3 0.1888727E-11 4 0.2619154E-11 5 0.4536905E-11 6 0.4269045E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.3737495E-14 1 0.1542293E-12 2 0.7084033E-12 3 0.1204652E-11 4 0.1429930E-11 5 0.2423299E-11 6 0.2223400E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.3230945E-13 1 0.5114234E-13 2 0.1141792E-12 3 0.3264766E-12 4 0.6047212E-12 5 0.3246082E-11 6 0.1907434E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.2782307E-15 1 0.4792396E-13 2 0.2087410E-12 3 0.4966761E-12 4 0.3762407E-11 5 0.1062626E-10 6 0.2595663E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.8428237E-16 1 0.1635238E-12 2 0.4840611E-12 3 0.9139780E-12 4 0.4245041E-11 5 0.1093831E-10 6 0.2356495E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1630315E-11 1 0.2555088E-11 2 0.2400827E-11 3 0.6999269E-11 4 0.1308926E-10 5 0.2358687E-09 6 0.5557969E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.7664057E-17 1 0.1269732E-09 2 0.3386638E-10 3 0.2687642E-09 4 0.4191990E-09 5 0.2842203E-09 6 0.6998441E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.2701783E-17 1 0.1361293E-08 2 0.8126772E-09 3 0.5315483E-08 4 0.8763627E-09 5 0.8245295E-08 6 0.1873621E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.3204516E-08 1 0.2001167E-07 2 0.1592979E-07 3 0.3077968E-07 4 0.3450136E-07 5 0.7079552E-08 6 0.1107460E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.6466608E-16 1 0.1152413E-06 2 0.1583422E-06 3 0.3703243E-06 4 0.1592846E-06 5 0.1271760E-06 6 0.2361628E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.3861117E-14 1 0.1100475E-05 2 0.7036988E-05 3 0.1454518E-04 4 0.1660941E-05 5 0.8855484E-07 6 0.6968941E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.3302168E-06 1 0.1523044E-05 2 0.2661004E-03 3 0.3469605E-03 4 0.3708143E-04 5 0.7715684E-06 6 0.3850110E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.2601413E-13 1 0.9937728E-04 2 0.7519840E-02 3 0.5562009E-02 4 0.4690504E-03 5 0.3452622E-05 6 0.7086243E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.2003382E-14 1 0.5469850E-02 2 0.8558609E-01 3 0.4486129E-01 4 0.2841575E-02 5 0.2077359E-04 6 0.8254177E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1986384E+00 1 0.4850191E-01 2 0.2779773E+00 3 0.1210822E+00 4 0.5091824E-02 5 0.3137041E-04 6 0.2231949E-06 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.5823826E-14 1 0.3305163E-01 2 0.5951662E-01 3 0.9607832E-01 4 0.9965061E-02 5 0.8533246E-04 6 0.1623328E-06 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.1999525E-18 1 0.6704127E-14 2 0.8437577E-14 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.2866085E-18 1 0.9747690E-13 2 0.2023293E-14 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.7310749E-16 1 0.1563518E-14 2 0.1086852E-14 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.2831473E-18 1 0.1321392E-14 2 0.3720484E-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 -6 0 0.8034322E-19 1 0.8797279E-15 2 0.2457674E-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 -5 0 0.2183930E-14 1 0.6148934E-14 2 0.1293536E-15 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.2826541E-19 1 0.7921243E-14 2 0.3777199E-15 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.1352390E-19 1 0.4362654E-14 2 0.1153436E-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 -2 0 0.5486720E-14 1 0.7094814E-13 2 0.1048922E-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 -1 0 0.1642885E-19 1 0.3811996E-12 2 0.2577019E-13 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.2765409E-19 1 0.3614369E-11 2 0.1849931E-12 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.4320572E-10 1 0.4852280E-10 2 0.9236364E-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 2 0 0.9080557E-20 1 0.3670891E-10 2 0.9901504E-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 3 0 0.2251690E-18 1 0.4495626E-09 2 0.5632294E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.1213992E-09 1 0.1003256E-08 2 0.3541698E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.2645357E-18 1 0.3762581E-07 2 0.8260961E-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 6 0 0.6847319E-19 1 0.8559213E-07 2 0.9685885E-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 0.3594940E-06 1 0.6976787E-07 2 0.1622854E-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 8 0 0.1956596E-18 1 0.4723871E-06 2 0.7758977E-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 9 0 0.1464468E-17 1 0.2777293E-06 2 0.5202834E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.9032367E-08 1 0.3538928E-07 2 0.1360283E-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 0 0 0 0.2570424E-14 1 0.3440253E-08 2 0.8465580E-09 3 0.1758913E-08 4 0.1016988E-08 5 0.6218563E-08 6 0.1414958E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.6536390E-11 1 0.1908327E-11 2 0.3100786E-10 3 0.3210769E-10 4 0.1140094E-09 5 0.2780274E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.2074108E-14 1 0.2017854E-09 2 0.2011924E-09 3 0.1982000E-09 4 0.8502683E-10 5 0.2051367E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.2365402E-14 1 0.1722366E-09 2 0.2408601E-08 3 0.8405688E-09 4 0.2671389E-08 5 0.5258653E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.2866843E-07 1 0.8085228E-07 2 0.5691153E-07 3 0.1247163E-07 4 0.8456125E-08 5 0.4549374E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.3434255E-14 1 0.8671296E-07 2 0.1844146E-07 3 0.6565496E-07 4 0.2150381E-07 5 0.2834766E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.1585975E-17 1 0.3285658E-13 2 0.1782769E-12 3 0.1417837E-11 4 0.1037312E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.2437352E-17 1 0.2276399E-12 2 0.1426927E-11 3 0.1796454E-11 4 0.1720277E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.4019365E-13 1 0.6714960E-12 2 0.3971495E-11 3 0.1036250E-10 4 0.2374155E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.7012036E-16 1 0.1445641E-10 2 0.8691862E-10 3 0.1877189E-09 4 0.1367028E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.5444020E-16 1 0.4382326E-09 2 0.4749018E-08 3 0.2932845E-08 4 0.1322537E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.7784191E-08 1 0.1378826E-07 2 0.5988237E-08 3 0.3660149E-08 4 0.1574495E-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 0.5258711E-16 1 0.2087047E-08 2 0.9170099E-08 3 0.1689918E-07 4 0.7030461E-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 0.3572888E-16 1 0.4206707E-06 2 0.2393299E-06 3 0.7262861E-07 4 0.2983329E-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 0.8768739E-08 1 0.5562062E-07 2 0.2391718E-06 3 0.1056236E-06 4 0.5574676E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 1.0032848 average vibrational energy (ev) = 0.000001 average rotational energy (ev) = 0.494991 average diffraction energy (ev) = 0.031231 the reaction probability = -0.3284801D-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 0.9981279E+00 0.4241430E-01 0.4948979E+00 1 0.1757926E-05 0.5116553E-01 0.1131917E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.4922442E-06 0 31 2 -2 0.1492538E-06 0 37 2 -1 0.1722321E-06 0 44 2 0 0.2094680E-06 0 50 2 1 0.6291263E-06 0 56 2 2 0.1799101E-05 0 21 4 -4 0.3997985E-07 0 26 4 -3 0.4406183E-07 0 32 4 -2 0.4571674E-07 0 38 4 -1 0.1532296E-06 0 45 4 0 0.6539487E-06 0 51 4 1 0.1614705E-05 0 57 4 2 0.2523056E-05 0 62 4 3 0.7208144E-05 0 67 4 4 0.7703262E-05 0 13 6 -6 0.1028729E-08 0 17 6 -5 0.1051030E-08 0 22 6 -4 0.8921199E-09 0 27 6 -3 0.1391701E-08 0 33 6 -2 0.4567422E-08 0 39 6 -1 0.4076980E-07 0 46 6 0 0.3842265E-06 0 52 6 1 0.3029505E-05 0 58 6 2 0.1784799E-04 0 63 6 3 0.6301752E-04 0 68 6 4 0.8657530E-04 0 72 6 5 0.1698615E-03 0 76 6 6 0.2439299E-03 0 7 8 -8 0.4234147E-10 0 10 8 -7 0.2940479E-10 0 14 8 -6 0.1480669E-10 0 18 8 -5 0.1937226E-10 0 23 8 -4 0.2752220E-10 0 28 8 -3 0.1074700E-09 0 34 8 -2 0.5062481E-09 0 40 8 -1 0.4843943E-08 0 47 8 0 0.3229129E-07 0 53 8 1 0.3021926E-06 0 59 8 2 0.6215030E-05 0 64 8 3 0.1722266E-03 0 69 8 4 0.3505321E-02 0 73 8 5 0.4103707E-01 0 77 8 6 0.2042251E+00 0 80 8 7 0.4086177E+00 0 83 8 8 0.3399493E+00 0 3 10 -10 0.1701064E-11 0 5 10 -9 0.5196064E-11 0 8 10 -8 0.1274897E-11 0 11 10 -7 0.6332843E-12 0 15 10 -6 0.5703001E-12 0 19 10 -5 0.2047621E-12 0 24 10 -4 0.2643829E-12 0 29 10 -3 0.6400287E-12 0 35 10 -2 0.5745040E-11 0 41 10 -1 0.6541179E-10 0 48 10 0 0.2979516E-09 0 54 10 1 0.2148347E-08 0 60 10 2 0.7190963E-08 0 65 10 3 0.1519230E-07 0 70 10 4 0.1477752E-06 0 74 10 5 0.2314391E-06 0 78 10 6 0.8997924E-06 0 81 10 7 0.8443622E-06 0 84 10 8 0.1778863E-05 0 86 10 9 0.1290068E-05 0 88 10 10 0.1339924E-05 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.3473720E-07 1 31 2 -2 0.1967496E-08 1 37 2 -1 0.2944260E-08 1 44 2 0 0.2809771E-07 1 50 2 1 0.1427518E-06 1 56 2 2 0.3667759E-06 1 21 4 -4 0.5086291E-10 1 26 4 -3 0.2992724E-10 1 32 4 -2 0.8924359E-10 1 38 4 -1 0.7434584E-09 1 45 4 0 0.7789636E-08 1 51 4 1 0.2484593E-07 1 57 4 2 0.5310564E-07 1 62 4 3 0.3680845E-06 1 67 4 4 0.6803145E-06 1 13 6 -6 0.2193686E-12 1 17 6 -5 0.2966139E-12 1 22 6 -4 0.5473898E-13 1 27 6 -3 0.2520675E-13 1 33 6 -2 0.3583129E-12 1 39 6 -1 0.7360836E-11 1 46 6 0 0.1156047E-09 1 52 6 1 0.5972728E-09 1 58 6 2 0.2546111E-09 1 63 6 3 0.2330392E-08 1 68 6 4 0.3660378E-08 1 72 6 5 0.9933867E-08 1 76 6 6 0.2869755E-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 0.5626013E-13 1 0.7793290E-08 2 0.3090026E-07 3 0.5015881E-07 4 0.1551991E-06 5 0.1022436E-06 6 0.7013854E-07 7 0.5173624E-07 8 0.1932736E-07 9 0.4746870E-08 v, j, mj = 0 2 -2 0 0.3483385E-09 1 0.1600218E-08 2 0.3905119E-08 3 0.3020237E-07 4 0.5851791E-07 5 0.2354330E-07 6 0.1921332E-07 7 0.6454514E-08 8 0.3880657E-08 9 0.1588049E-08 v, j, mj = 0 2 -1 0 0.3421584E-15 1 0.1749358E-07 2 0.2607686E-07 3 0.3784163E-07 4 0.3841412E-07 5 0.1985573E-07 6 0.9442731E-08 7 0.1755165E-07 8 0.4242162E-08 9 0.1313636E-08 v, j, mj = 0 2 0 0 0.9967914E-14 1 0.2052366E-08 2 0.3069124E-07 3 0.3593117E-07 4 0.2313174E-07 5 0.2743695E-07 6 0.3883143E-07 7 0.3476894E-07 8 0.1340397E-07 9 0.3220184E-08 v, j, mj = 0 2 1 0 0.1091292E-07 1 0.9019914E-08 2 0.1051676E-06 3 0.1564153E-06 4 0.1152446E-06 5 0.9345317E-07 6 0.4934794E-07 7 0.6657700E-07 8 0.2030502E-07 9 0.2682748E-08 v, j, mj = 0 2 2 0 0.2899840E-13 1 0.3736938E-07 2 0.1030606E-06 3 0.1342366E-06 4 0.3338122E-06 5 0.3729873E-06 6 0.5631902E-06 7 0.1606918E-06 8 0.8215174E-07 9 0.1160147E-07 v, j, mj = 0 4 -4 0 0.4782154E-13 1 0.1493605E-08 2 0.9463316E-08 3 0.1101757E-07 4 0.9966596E-08 5 0.4717192E-08 6 0.2186011E-08 7 0.5847714E-09 8 0.2814426E-09 9 0.2692994E-09 v, j, mj = 0 4 -3 0 0.2797068E-13 1 0.1253392E-07 2 0.1160598E-07 3 0.7759491E-08 4 0.6257297E-08 5 0.2297187E-08 6 0.1219505E-08 7 0.1664181E-08 8 0.3742442E-09 9 0.3499910E-09 v, j, mj = 0 4 -2 0 0.1281603E-10 1 0.5620714E-08 2 0.1260896E-07 3 0.1000572E-07 4 0.8656068E-08 5 0.3112864E-08 6 0.2608662E-08 7 0.2166321E-08 8 0.5283040E-09 9 0.3963120E-09 v, j, mj = 0 4 -1 0 0.9058476E-14 1 0.4272741E-07 2 0.4851998E-08 3 0.5148924E-07 4 0.3561033E-07 5 0.3409313E-08 6 0.5933381E-08 7 0.5103617E-08 8 0.2608503E-08 9 0.1495837E-08 v, j, mj = 0 4 0 0 0.8886704E-15 1 0.9113462E-07 2 0.9712864E-07 3 0.3324386E-06 4 0.9218966E-07 5 0.1274907E-07 6 0.1541733E-07 7 0.9598458E-08 8 0.2748346E-08 9 0.5439351E-09 v, j, mj = 0 4 1 0 0.1249504E-06 1 0.6680044E-07 2 0.5855370E-06 3 0.6357112E-06 4 0.8688252E-07 5 0.3539705E-07 6 0.4263972E-07 7 0.2733627E-07 8 0.6681523E-08 9 0.2768972E-08 v, j, mj = 0 4 2 0 0.2852694E-15 1 0.2615921E-06 2 0.1117027E-05 3 0.5051579E-06 4 0.2067751E-06 5 0.1553491E-06 6 0.1655981E-06 7 0.1018148E-06 8 0.7259779E-08 9 0.2481179E-08 v, j, mj = 0 4 3 0 0.8736680E-13 1 0.8512091E-06 2 0.2433781E-05 3 0.7443041E-06 4 0.1362673E-05 5 0.8326016E-06 6 0.6062972E-06 7 0.3686129E-06 8 0.6228626E-08 9 0.2435879E-08 v, j, mj = 0 4 4 0 0.3180329E-07 1 0.3020049E-07 2 0.3582389E-06 3 0.6253685E-06 4 0.5827209E-06 5 0.4469900E-05 6 0.1039856E-05 7 0.5186545E-06 8 0.3230670E-07 9 0.1421304E-07 v, j, mj = 0 6 -6 0 0.2397067E-12 1 0.6952315E-10 2 0.1912078E-09 3 0.2521308E-09 4 0.2071525E-09 5 0.7141919E-10 6 0.8087118E-10 7 0.6739191E-10 8 0.7884928E-10 9 0.9943762E-11 v, j, mj = 0 6 -5 0 0.1606151E-09 1 0.1302568E-09 2 0.2860444E-09 3 0.1414767E-09 4 0.1759589E-09 5 0.5242966E-10 6 0.3573068E-10 7 0.2866134E-10 8 0.3592164E-10 9 0.3934634E-11 v, j, mj = 0 6 -4 0 0.1351459E-13 1 0.2904280E-10 2 0.1841936E-09 3 0.2348621E-09 4 0.9022217E-10 5 0.3950024E-10 6 0.1198834E-09 7 0.8329094E-10 8 0.1005843E-09 9 0.1052691E-10 v, j, mj = 0 6 -3 0 0.1828089E-13 1 0.3101353E-09 2 0.2082856E-09 3 0.1022656E-09 4 0.1741413E-09 5 0.9784002E-10 6 0.2071665E-09 7 0.1462741E-09 8 0.1348130E-09 9 0.1076156E-10 v, j, mj = 0 6 -2 0 0.9026530E-10 1 0.1514153E-09 2 0.4452617E-09 3 0.8904453E-09 4 0.5997154E-09 5 0.5013542E-09 6 0.6414950E-09 7 0.6205475E-09 8 0.5950943E-09 9 0.3182759E-10 v, j, mj = 0 6 -1 0 0.1976395E-14 1 0.7418371E-08 2 0.6069373E-08 3 0.9107494E-08 4 0.9670165E-08 5 0.4318458E-08 6 0.1593019E-08 7 0.1164498E-08 8 0.1323628E-08 9 0.1047902E-09 v, j, mj = 0 6 0 0 0.9559022E-15 1 0.7735510E-07 2 0.2514814E-07 3 0.1606911E-06 4 0.8713698E-07 5 0.1856449E-07 6 0.3549492E-08 7 0.7243587E-08 8 0.4339469E-08 9 0.1981374E-09 v, j, mj = 0 6 1 0 0.2123853E-06 1 0.2301137E-07 2 0.3728760E-06 3 0.1543996E-05 4 0.7505509E-06 5 0.8624987E-07 6 0.2372568E-07 7 0.9635106E-08 8 0.6649671E-08 9 0.4250940E-09 v, j, mj = 0 6 2 0 0.4134979E-13 1 0.3730065E-06 2 0.5774016E-05 3 0.8538874E-05 4 0.2871180E-05 5 0.1967759E-06 6 0.5671833E-07 7 0.2711139E-07 8 0.9859197E-08 9 0.4437963E-09 v, j, mj = 0 6 3 0 0.5774260E-12 1 0.2338599E-06 2 0.2708164E-04 3 0.2987485E-04 4 0.5291050E-05 5 0.3825872E-06 6 0.1158342E-06 7 0.2766653E-07 8 0.9155931E-08 9 0.8804177E-09 v, j, mj = 0 6 4 0 0.1724092E-06 1 0.2275189E-04 2 0.2637546E-04 3 0.2979560E-04 4 0.5682233E-05 5 0.1208198E-05 6 0.4861503E-06 7 0.7793496E-07 8 0.2443125E-07 9 0.9973546E-09 v, j, mj = 0 6 5 0 0.1111027E-11 1 0.1023046E-03 2 0.2010176E-04 3 0.1489862E-04 4 0.2503041E-04 5 0.6662370E-05 6 0.7098779E-06 7 0.1204785E-06 8 0.3131016E-07 9 0.2144967E-08 v, j, mj = 0 6 6 0 0.9373635E-13 1 0.2273530E-05 2 0.8947649E-04 3 0.1532751E-04 4 0.5561868E-04 5 0.7058915E-04 6 0.1019091E-04 7 0.4212076E-06 8 0.3088319E-07 9 0.1480127E-08 v, j, mj = 0 8 -8 0 0.1614041E-12 1 0.9764094E-12 2 0.2857966E-11 3 0.3520040E-11 4 0.4705817E-11 5 0.1016350E-10 6 0.1547400E-10 7 0.4482333E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.6341796E-13 1 0.6515771E-12 2 0.2754980E-11 3 0.1983252E-11 4 0.1548168E-11 5 0.7311464E-11 6 0.1275382E-10 7 0.2338112E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.3962898E-13 1 0.6106934E-12 2 0.3378887E-12 3 0.5132996E-12 4 0.1864759E-11 5 0.4667172E-11 6 0.3930710E-11 7 0.2842538E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1241846E-12 1 0.6221685E-13 2 0.3055311E-12 3 0.1469941E-11 4 0.1413418E-11 5 0.4305704E-11 6 0.8846181E-11 7 0.2845087E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.3496124E-14 1 0.2734623E-12 2 0.6577803E-12 3 0.5897020E-12 4 0.3567390E-11 5 0.1129517E-10 6 0.1052178E-10 7 0.6134142E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.1122249E-14 1 0.8952172E-12 2 0.2905862E-11 3 0.4419076E-11 4 0.5308545E-11 5 0.3263980E-10 6 0.5861761E-10 7 0.2682760E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.5085964E-11 1 0.7916080E-11 2 0.1293440E-10 3 0.3588308E-10 4 0.4354223E-10 5 0.1833395E-09 6 0.1950718E-09 7 0.2247502E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.2581093E-15 1 0.1395931E-09 2 0.1523610E-09 3 0.6374450E-09 4 0.8115259E-09 5 0.7136921E-09 6 0.2236484E-08 7 0.1528420E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.5933178E-16 1 0.4386473E-08 2 0.3796622E-08 3 0.8070533E-08 4 0.5200406E-08 5 0.4435863E-08 6 0.5775224E-08 7 0.6261689E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.2061563E-08 1 0.3776171E-07 2 0.1917474E-07 3 0.9365490E-07 4 0.9886199E-07 5 0.1100358E-07 6 0.3806757E-07 7 0.1606499E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.1779516E-14 1 0.2923557E-06 2 0.9188188E-06 3 0.3493420E-05 4 0.1395542E-05 5 0.7003198E-07 6 0.4193552E-07 7 0.2926172E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.1085502E-12 1 0.9963215E-06 2 0.3961862E-04 3 0.1055344E-03 4 0.2484723E-04 5 0.1073910E-05 6 0.1542219E-06 7 0.1829865E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.8628867E-07 1 0.3844813E-04 2 0.1135546E-02 3 0.1942876E-02 4 0.3775615E-03 5 0.1063546E-04 6 0.1640970E-06 7 0.4128719E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.3771780E-12 1 0.8431503E-03 2 0.1663280E-01 3 0.2030311E-01 4 0.3181548E-02 5 0.7596528E-04 6 0.4946856E-06 7 0.6303817E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1278712E-13 1 0.7305810E-03 2 0.9401075E-01 3 0.9616074E-01 4 0.1304083E-01 5 0.2814078E-03 6 0.7848683E-06 7 0.1298517E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1044843E+00 1 0.1178044E+00 2 0.7221941E-01 3 0.1005188E+00 4 0.1334189E-01 5 0.2483563E-03 6 0.5407961E-06 7 0.5160472E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.5455714E-13 1 0.5345330E-01 2 0.6798921E-01 3 0.1509776E+00 4 0.6517718E-01 5 0.2342957E-02 6 0.9074250E-05 7 0.4027686E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.3939670E-18 1 0.7213550E-12 2 0.6031843E-12 3 0.3765243E-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 0.1650371E-17 1 0.6285647E-12 2 0.4097191E-11 3 0.4703064E-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 0.1252646E-15 1 0.4475476E-13 2 0.4108068E-12 3 0.8192103E-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 0.2291092E-17 1 0.4024892E-13 2 0.3481656E-12 3 0.2448675E-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 0.2312627E-18 1 0.3920410E-13 2 0.3769360E-12 3 0.1541598E-12 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.2962681E-13 1 0.1931904E-13 2 0.1103608E-12 3 0.4545544E-13 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.8040357E-18 1 0.8133342E-13 2 0.1241587E-12 3 0.5888996E-13 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.8861168E-18 1 0.9616575E-13 2 0.2725344E-12 3 0.2713276E-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 -2 0 0.2878035E-13 1 0.1008014E-12 2 0.2229963E-11 3 0.3385495E-11 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.3092798E-18 1 0.8082521E-12 2 0.4529914E-10 3 0.1930439E-10 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.5129814E-19 1 0.7979572E-11 2 0.2253234E-09 3 0.6464858E-10 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.5226060E-10 1 0.1175824E-09 2 0.1781919E-08 3 0.1965844E-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 0.5561358E-19 1 0.3989108E-09 2 0.4546101E-08 3 0.2245951E-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 0.1154425E-17 1 0.3886677E-08 2 0.8239026E-08 3 0.3066593E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.8714794E-09 1 0.1494115E-07 2 0.6823721E-07 3 0.6372538E-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 0.2452852E-17 1 0.7055693E-07 2 0.8434226E-07 3 0.7653992E-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 0.8410082E-19 1 0.2408237E-07 2 0.6887661E-06 3 0.1869439E-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 7 0 0.2241778E-06 1 0.2645727E-06 2 0.2506110E-06 3 0.1050006E-06 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.2156415E-17 1 0.6301961E-07 2 0.1613565E-05 3 0.1022782E-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 9 0 0.1304002E-16 1 0.9318837E-06 2 0.2214471E-06 3 0.1367373E-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 10 0 0.7443056E-07 1 0.2833065E-06 2 0.3854266E-06 3 0.5967601E-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 = 1 0 0 0 0.8154678E-14 1 0.1365997E-07 2 0.5088078E-08 3 0.1018737E-08 4 0.1981161E-08 5 0.6141082E-08 6 0.6803880E-08 7 0.4428457E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.1619190E-11 1 0.4970771E-10 2 0.2288283E-09 3 0.2492006E-09 4 0.2179141E-09 5 0.2744812E-09 6 0.9457446E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.4644262E-14 1 0.9854710E-09 2 0.5882154E-09 3 0.5427297E-09 4 0.1679933E-09 5 0.2935559E-09 6 0.3662905E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.5585310E-14 1 0.1172976E-08 2 0.1219058E-07 3 0.3813670E-08 4 0.2709011E-08 5 0.4853376E-08 6 0.3358094E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.7343936E-08 1 0.5141257E-07 2 0.5652325E-07 3 0.1387155E-07 4 0.8395288E-08 5 0.3253808E-08 6 0.1951374E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.3338463E-14 1 0.6010337E-07 2 0.5320708E-07 3 0.1140566E-06 4 0.9220774E-07 5 0.4164864E-07 6 0.5552416E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.2388470E-14 1 0.2174188E-11 2 0.4144647E-11 3 0.9421219E-11 4 0.3440180E-10 5 0.7186719E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.7037133E-15 1 0.4444007E-12 2 0.3101019E-11 3 0.2602527E-11 4 0.2247594E-10 5 0.1302654E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.8081511E-13 1 0.1341192E-11 2 0.1812495E-10 3 0.2121469E-10 4 0.4642800E-10 5 0.2053944E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.7189114E-15 1 0.1062855E-09 2 0.1776430E-09 3 0.1809561E-09 4 0.2651261E-09 5 0.1344694E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.2531841E-15 1 0.1170484E-08 2 0.4569914E-09 3 0.5468636E-08 4 0.5987984E-09 5 0.9472587E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.6314246E-08 1 0.1549059E-08 2 0.1245302E-07 3 0.1747455E-08 4 0.2527966E-08 5 0.2541874E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.3353578E-15 1 0.1681801E-07 2 0.1077807E-07 3 0.1732375E-07 4 0.6642206E-08 5 0.1543612E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.1674600E-13 1 0.2010579E-07 2 0.2800734E-06 3 0.3986132E-07 4 0.2530633E-07 5 0.2737658E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.7679227E-08 1 0.2059363E-07 2 0.2759200E-06 3 0.3088555E-06 4 0.6494793E-07 5 0.2318230E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.1150527E-18 1 0.2135227E-12 2 0.5845855E-14 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.2012545E-12 1 0.6470246E-13 2 0.3065697E-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 -4 0 0.6172749E-18 1 0.5032892E-13 2 0.4409448E-14 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.6858886E-19 1 0.2460832E-13 2 0.5983672E-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 = 1 6 -2 0 0.3073719E-13 1 0.2253041E-12 2 0.1022716E-12 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.1860863E-18 1 0.5407440E-11 2 0.1953396E-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 0 0 0.7412805E-19 1 0.1042435E-09 2 0.1136119E-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 0.2868015E-09 1 0.2916147E-09 2 0.1885657E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.1134779E-18 1 0.2519575E-09 2 0.2653609E-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 0.1469338E-17 1 0.1926249E-08 2 0.4041435E-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 4 0 0.1121479E-08 1 0.2426284E-08 2 0.1126151E-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 0.3322943E-18 1 0.9664879E-08 2 0.2689880E-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 0.4308726E-18 1 0.2805299E-07 2 0.6445655E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9981297 average vibrational energy (ev) = 0.000001 average rotational energy (ev) = 0.494897 average diffraction energy (ev) = 0.042414 the reaction probability = 0.1870298D-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 0.9978941E+00 0.5109755E-01 0.4944833E+00 1 0.1344562E-04 0.4432308E-01 0.1372807E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.4094353E-05 0 31 2 -2 0.1960571E-05 0 37 2 -1 0.1506055E-05 0 44 2 0 0.1448219E-05 0 50 2 1 0.4411916E-05 0 56 2 2 0.1430944E-04 0 21 4 -4 0.1156135E-05 0 26 4 -3 0.4057898E-06 0 32 4 -2 0.3994226E-06 0 38 4 -1 0.1465284E-05 0 45 4 0 0.4383410E-05 0 51 4 1 0.1056990E-04 0 57 4 2 0.1181164E-04 0 62 4 3 0.3914472E-04 0 67 4 4 0.6096639E-04 0 13 6 -6 0.8263278E-07 0 17 6 -5 0.2564534E-07 0 22 6 -4 0.6210121E-08 0 27 6 -3 0.8091547E-08 0 33 6 -2 0.3590403E-07 0 39 6 -1 0.3331348E-06 0 46 6 0 0.2907566E-05 0 52 6 1 0.2082955E-04 0 58 6 2 0.1003402E-03 0 63 6 3 0.2453621E-03 0 68 6 4 0.2332301E-03 0 72 6 5 0.5608411E-03 0 76 6 6 0.1242024E-02 0 7 8 -8 0.1654072E-09 0 10 8 -7 0.1074041E-09 0 14 8 -6 0.7399472E-10 0 18 8 -5 0.7165148E-10 0 23 8 -4 0.7743670E-10 0 28 8 -3 0.2306288E-09 0 34 8 -2 0.1726395E-08 0 40 8 -1 0.1292060E-07 0 47 8 0 0.1226728E-06 0 53 8 1 0.2089396E-05 0 59 8 2 0.6152264E-04 0 64 8 3 0.1216046E-02 0 69 8 4 0.1455242E-01 0 73 8 5 0.8792267E-01 0 77 8 6 0.2087065E+00 0 80 8 7 0.2610361E+00 0 83 8 8 0.4218236E+00 0 3 10 -10 0.5239947E-11 0 5 10 -9 0.6072742E-11 0 8 10 -8 0.4135102E-11 0 11 10 -7 0.3290224E-11 0 15 10 -6 0.1615127E-11 0 19 10 -5 0.7583098E-12 0 24 10 -4 0.2635033E-11 0 29 10 -3 0.1335130E-10 0 35 10 -2 0.6628345E-10 0 41 10 -1 0.2489864E-09 0 48 10 0 0.1310568E-08 0 54 10 1 0.4457642E-08 0 60 10 2 0.2819004E-07 0 65 10 3 0.7504816E-07 0 70 10 4 0.1704788E-06 0 74 10 5 0.7510038E-06 0 78 10 6 0.1122566E-05 0 81 10 7 0.1428146E-05 0 84 10 8 0.1430825E-05 0 86 10 9 0.1914852E-05 0 88 10 10 0.2077121E-05 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.9670219E-07 1 31 2 -2 0.7499486E-08 1 37 2 -1 0.1486095E-07 1 44 2 0 0.5768933E-07 1 50 2 1 0.3709516E-06 1 56 2 2 0.1099367E-05 1 21 4 -4 0.1486625E-09 1 26 4 -3 0.1409468E-09 1 32 4 -2 0.5647622E-09 1 38 4 -1 0.2959399E-08 1 45 4 0 0.1816897E-07 1 51 4 1 0.5825369E-07 1 57 4 2 0.2000296E-06 1 62 4 3 0.1667702E-05 1 67 4 4 0.9231303E-05 1 13 6 -6 0.3313116E-11 1 17 6 -5 0.3874387E-11 1 22 6 -4 0.4319496E-11 1 27 6 -3 0.2585452E-11 1 33 6 -2 0.1694485E-10 1 39 6 -1 0.6276872E-09 1 46 6 0 0.2161747E-08 1 52 6 1 0.2312996E-08 1 58 6 2 0.4211610E-08 1 63 6 3 0.2918020E-07 1 68 6 4 0.4100060E-07 1 72 6 5 0.3211432E-06 1 76 6 6 0.2186114E-06 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 0.1704334E-12 1 0.2462148E-07 2 0.2195628E-06 3 0.1854001E-06 4 0.1189710E-05 5 0.1269993E-05 6 0.8508896E-06 7 0.2893002E-06 8 0.5879948E-07 9 0.6075873E-08 v, j, mj = 0 2 -2 0 0.1176009E-09 1 0.3238976E-07 2 0.2271063E-07 3 0.3360257E-06 4 0.6324737E-06 5 0.5205087E-06 6 0.3115630E-06 7 0.8944517E-07 8 0.1372262E-07 9 0.1614221E-08 v, j, mj = 0 2 -1 0 0.2716044E-12 1 0.3724612E-06 2 0.3549300E-06 3 0.3087919E-06 4 0.2169191E-06 5 0.1485480E-06 6 0.6925000E-07 7 0.2670174E-07 8 0.5894392E-08 9 0.2557955E-08 v, j, mj = 0 2 0 0 0.1717413E-12 1 0.4656071E-08 2 0.2184189E-06 3 0.2592053E-06 4 0.1520937E-06 5 0.3408743E-06 6 0.2777002E-06 7 0.1635346E-06 8 0.2825697E-07 9 0.3478625E-08 v, j, mj = 0 2 1 0 0.4467579E-07 1 0.2413954E-06 2 0.9465592E-06 3 0.3761363E-06 4 0.9105863E-06 5 0.1041304E-05 6 0.5586057E-06 7 0.2066728E-06 8 0.7910578E-07 9 0.6874491E-08 v, j, mj = 0 2 2 0 0.5259634E-13 1 0.9854649E-07 2 0.5451911E-06 3 0.6361556E-06 4 0.2292344E-05 5 0.4700902E-05 6 0.4572851E-05 7 0.1031496E-05 8 0.4218005E-06 9 0.1015439E-07 v, j, mj = 0 4 -4 0 0.1688476E-12 1 0.5053436E-08 2 0.1792387E-06 3 0.2379552E-06 4 0.3511075E-06 5 0.2574419E-06 6 0.1057653E-06 7 0.1774523E-07 8 0.1257850E-08 9 0.5696611E-09 v, j, mj = 0 4 -3 0 0.3134342E-13 1 0.1403995E-06 2 0.1320566E-06 3 0.2893068E-07 4 0.6347665E-07 5 0.2800483E-07 6 0.9908814E-08 7 0.2292141E-08 8 0.4077099E-09 9 0.3129271E-09 v, j, mj = 0 4 -2 0 0.4234914E-09 1 0.4293435E-07 2 0.5497325E-07 3 0.1218754E-06 4 0.1305540E-06 5 0.2977514E-07 6 0.1148330E-07 7 0.5844188E-08 8 0.1126429E-08 9 0.4330618E-09 v, j, mj = 0 4 -1 0 0.1346655E-12 1 0.4521719E-06 2 0.4925307E-07 3 0.6452917E-06 4 0.2740857E-06 5 0.2617026E-07 6 0.8021558E-08 7 0.6866785E-08 8 0.2518851E-08 9 0.9043231E-09 v, j, mj = 0 4 0 0 0.1338946E-13 1 0.4924997E-06 2 0.7964194E-06 3 0.2614723E-05 4 0.3347798E-06 5 0.9838001E-07 6 0.2676700E-07 7 0.1605483E-07 8 0.2689487E-08 9 0.1096857E-08 v, j, mj = 0 4 1 0 0.1348085E-05 1 0.2123237E-06 2 0.4223262E-05 3 0.3968707E-05 4 0.4154668E-06 5 0.2165673E-06 6 0.1322419E-06 7 0.4284791E-07 8 0.6542984E-08 9 0.3856139E-08 v, j, mj = 0 4 2 0 0.3738087E-13 1 0.4683196E-06 2 0.6085220E-05 3 0.1297425E-05 4 0.1960208E-05 5 0.9493319E-06 6 0.7943755E-06 7 0.2336865E-06 8 0.1939796E-07 9 0.3672864E-08 v, j, mj = 0 4 3 0 0.1328050E-12 1 0.3968509E-05 2 0.8430758E-05 3 0.9872647E-05 4 0.3688708E-05 5 0.8140496E-05 6 0.4182580E-05 7 0.8433402E-06 8 0.8875489E-08 9 0.8802590E-08 v, j, mj = 0 4 4 0 0.3720280E-07 1 0.1505714E-05 2 0.5928678E-05 3 0.9989189E-06 4 0.3116592E-05 5 0.2450329E-04 6 0.1801078E-04 7 0.6509010E-05 8 0.3410802E-06 9 0.1512095E-07 v, j, mj = 0 6 -6 0 0.6716500E-12 1 0.1087797E-08 2 0.1098033E-07 3 0.2301197E-07 4 0.2626680E-07 5 0.1716746E-07 6 0.3899934E-08 7 0.1027222E-09 8 0.6881157E-10 9 0.4628029E-10 v, j, mj = 0 6 -5 0 0.1446914E-08 1 0.2124061E-09 2 0.1460578E-08 3 0.5899152E-08 4 0.1007801E-07 5 0.5196226E-08 6 0.1186429E-08 7 0.7111453E-10 8 0.5209626E-10 9 0.4241334E-10 v, j, mj = 0 6 -4 0 0.5300586E-13 1 0.5599161E-10 2 0.2468145E-08 3 0.1250366E-08 4 0.1566275E-08 5 0.3177871E-09 6 0.2268410E-09 7 0.1589987E-09 8 0.9499161E-10 9 0.7067189E-10 v, j, mj = 0 6 -3 0 0.3760830E-13 1 0.2833872E-08 2 0.1609145E-08 3 0.1050543E-08 4 0.1483811E-08 5 0.2567549E-09 6 0.2993549E-09 7 0.1799453E-09 8 0.2439061E-09 9 0.1341778E-09 v, j, mj = 0 6 -2 0 0.2725960E-09 1 0.5128761E-09 2 0.4356280E-08 3 0.1493398E-07 4 0.1159235E-07 5 0.1563384E-08 6 0.6446110E-09 7 0.8909163E-09 8 0.7517040E-09 9 0.3853334E-09 v, j, mj = 0 6 -1 0 0.1482896E-13 1 0.2037719E-07 2 0.4615562E-07 3 0.1315909E-06 4 0.1134969E-06 5 0.1475998E-07 6 0.2148726E-08 7 0.2250537E-08 8 0.1922958E-08 9 0.4320296E-09 v, j, mj = 0 6 0 0 0.1034177E-13 1 0.2527723E-06 2 0.2820970E-06 3 0.1616186E-05 4 0.6611571E-06 5 0.7292365E-07 6 0.8140687E-08 7 0.7918392E-08 8 0.3659567E-08 9 0.2711658E-08 v, j, mj = 0 6 1 0 0.5114549E-06 1 0.3145768E-07 2 0.3560018E-05 3 0.1324865E-04 4 0.3191990E-05 5 0.2513911E-06 6 0.2071287E-07 7 0.4506917E-08 8 0.7944495E-08 9 0.1423783E-08 v, j, mj = 0 6 2 0 0.2242364E-12 1 0.1684191E-06 2 0.4130423E-04 3 0.4754433E-04 4 0.1036292E-04 5 0.7958055E-06 6 0.1132998E-06 7 0.3397081E-07 8 0.1016887E-07 9 0.7092517E-08 v, j, mj = 0 6 3 0 0.1981400E-11 1 0.6526321E-05 2 0.1378416E-03 3 0.7637013E-04 4 0.1892329E-04 5 0.4607912E-05 6 0.1016045E-05 7 0.5700845E-07 8 0.1038075E-07 9 0.9472172E-08 v, j, mj = 0 6 4 0 0.3782221E-06 1 0.7268882E-04 2 0.5502801E-04 3 0.6061019E-04 4 0.2561500E-04 5 0.1594263E-04 6 0.2621915E-05 7 0.3150530E-06 8 0.2010089E-07 9 0.1019813E-07 v, j, mj = 0 6 5 0 0.2264121E-11 1 0.2283079E-03 2 0.1118048E-03 3 0.3507345E-04 4 0.9218564E-04 5 0.7457077E-04 6 0.1752301E-04 7 0.1318495E-05 8 0.4497837E-07 9 0.1202976E-07 v, j, mj = 0 6 6 0 0.1616303E-12 1 0.6458625E-04 2 0.2181388E-03 3 0.1342879E-03 4 0.2561148E-03 5 0.4600348E-03 6 0.1047560E-03 7 0.4007271E-05 8 0.9460414E-07 9 0.3938259E-08 v, j, mj = 0 8 -8 0 0.6190537E-12 1 0.5316275E-11 2 0.3376843E-10 3 0.5446487E-10 4 0.3056992E-10 5 0.4999505E-11 6 0.1332072E-10 7 0.2234845E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1183751E-12 1 0.2917302E-11 2 0.2296849E-10 3 0.4801975E-10 4 0.1000092E-10 5 0.4163310E-11 6 0.1236932E-10 7 0.6846616E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.1158905E-12 1 0.5812356E-11 2 0.2731431E-11 3 0.1399618E-10 4 0.4015905E-11 5 0.8592860E-11 6 0.2197650E-10 7 0.1675361E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.2946652E-12 1 0.3122817E-11 2 0.2495666E-11 3 0.4363706E-11 4 0.6530406E-11 5 0.6128281E-11 6 0.1325069E-10 7 0.3546525E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.6257438E-14 1 0.3138556E-11 2 0.7382022E-11 3 0.4515557E-11 4 0.3485730E-11 5 0.1076541E-10 6 0.3120538E-10 7 0.1693779E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.5611403E-14 1 0.2946968E-11 2 0.1598796E-10 3 0.1513168E-10 4 0.2216624E-10 5 0.2855177E-10 6 0.5050048E-10 7 0.9533809E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.2206253E-10 1 0.3810185E-10 2 0.1651268E-09 3 0.2055960E-09 4 0.2113595E-09 5 0.2537701E-09 6 0.4521241E-09 7 0.3782545E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.3489902E-14 1 0.9907752E-09 2 0.3675588E-08 3 0.1668667E-08 4 0.2329359E-08 5 0.1806770E-08 6 0.9408485E-09 7 0.1508585E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.5172297E-15 1 0.2450509E-07 2 0.3285371E-07 3 0.1927091E-07 4 0.3046673E-07 5 0.4574335E-08 6 0.5111209E-08 7 0.5890787E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.1490603E-07 1 0.8774210E-07 2 0.1217392E-06 3 0.1071567E-05 4 0.7383933E-06 5 0.2913937E-07 6 0.1492452E-07 7 0.1098518E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.2261760E-13 1 0.1218036E-05 2 0.9671835E-05 3 0.3631282E-04 4 0.1350876E-04 5 0.7607965E-06 6 0.2715097E-07 7 0.2323685E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.1260463E-11 1 0.6232092E-05 2 0.3287466E-03 3 0.6745615E-03 4 0.1949597E-03 5 0.1141675E-04 6 0.1137616E-06 7 0.1500099E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.2523189E-07 1 0.2713607E-03 2 0.4942309E-02 3 0.7383214E-02 4 0.1859126E-02 5 0.9537572E-04 6 0.9993346E-06 7 0.1139149E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.2224269E-11 1 0.2393300E-02 2 0.3103008E-01 3 0.4393409E-01 4 0.1008142E-01 5 0.4794098E-03 6 0.4356670E-05 7 0.2251246E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1199441E-13 1 0.8183074E-02 2 0.6067629E-01 3 0.1156705E+00 4 0.2307400E-01 5 0.1092325E-02 6 0.1022468E-04 7 0.5916907E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.4955175E-01 1 0.1063139E+00 2 0.7537034E-01 3 0.2163682E-01 4 0.7089133E-02 5 0.1053612E-02 6 0.2038453E-04 7 0.1536036E-06 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.2740103E-12 1 0.4695275E-01 2 0.1232059E+00 3 0.9292167E-01 4 0.1410155E+00 5 0.1752410E-01 6 0.2035246E-03 7 0.1148548E-06 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.6962449E-16 1 0.8105643E-12 2 0.5952083E-12 3 0.7750213E-12 4 0.3059084E-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 0.7584510E-16 1 0.3794881E-12 2 0.1819276E-11 3 0.2748476E-11 4 0.1125427E-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 0.1570902E-14 1 0.3547872E-13 2 0.1284144E-12 3 0.1626160E-11 4 0.2343478E-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 0.3044384E-16 1 0.8193871E-13 2 0.6001243E-12 3 0.8214142E-12 4 0.1786716E-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 0.8132129E-17 1 0.7349065E-13 2 0.1765845E-12 3 0.2919371E-12 4 0.1073107E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.1492268E-13 1 0.3144162E-12 2 0.9599103E-13 3 0.1724759E-12 4 0.1605039E-12 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.4348630E-18 1 0.2454719E-13 2 0.1685813E-12 3 0.8817956E-12 4 0.1560108E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.1274623E-17 1 0.9183499E-12 2 0.1569733E-11 3 0.2045805E-11 4 0.8817411E-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 -2 0 0.1201799E-12 1 0.1439298E-11 2 0.8561527E-11 3 0.2306282E-10 4 0.3309963E-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 -1 0 0.1911252E-17 1 0.5690914E-12 2 0.1455874E-10 3 0.1010205E-09 4 0.1328381E-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 0 0 0.3378069E-18 1 0.5143850E-10 2 0.5718561E-10 3 0.2136900E-09 4 0.9882536E-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 0.3105434E-10 1 0.6976410E-10 2 0.1105400E-08 3 0.1236319E-08 4 0.2015104E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.3107020E-17 1 0.4762380E-09 2 0.3564834E-08 3 0.4323545E-08 4 0.1982543E-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 0.1994327E-16 1 0.4594548E-08 2 0.1459576E-07 3 0.3355611E-07 4 0.2230174E-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 0.3697583E-08 1 0.1285197E-07 2 0.3104835E-07 3 0.7808458E-07 4 0.4479632E-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 0.1640973E-16 1 0.7244498E-07 2 0.1639383E-06 3 0.2628228E-06 4 0.2517977E-06 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.1034704E-17 1 0.1692345E-06 2 0.4737471E-06 3 0.3317591E-06 4 0.1478255E-06 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.6238624E-06 1 0.5434199E-06 2 0.3904963E-07 3 0.1573007E-06 4 0.6451332E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.5833256E-16 1 0.2305238E-06 2 0.7052939E-06 3 0.3156469E-06 4 0.1793605E-06 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.1073372E-14 1 0.3601804E-06 2 0.1337504E-05 3 0.1187686E-06 4 0.9839815E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.1246338E-06 1 0.5721867E-06 2 0.2659409E-06 3 0.8160747E-06 4 0.2982848E-06 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.1464973E-14 1 0.3284909E-07 2 0.2220698E-07 3 0.1251932E-07 4 0.1784834E-07 5 0.6277515E-08 6 0.2464707E-08 7 0.2536230E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.2618817E-10 1 0.1759323E-09 2 0.1987674E-08 3 0.2955530E-08 4 0.1101933E-08 5 0.5487723E-09 6 0.6640597E-09 7 0.3939679E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.2882819E-13 1 0.6466365E-08 2 0.3974448E-08 3 0.2382222E-08 4 0.8184937E-09 5 0.7258532E-09 6 0.4136768E-09 7 0.7985810E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.1074394E-13 1 0.1510483E-07 2 0.1743521E-07 3 0.7357812E-08 4 0.6977023E-08 5 0.6436996E-08 6 0.3821057E-08 7 0.5563965E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.7339114E-07 1 0.4006543E-07 2 0.1140731E-06 3 0.1162195E-06 4 0.2189082E-07 5 0.2699664E-08 6 0.2339449E-08 7 0.2724856E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.2438939E-13 1 0.4725096E-07 2 0.2695934E-06 3 0.4085733E-06 4 0.2619164E-06 5 0.9022689E-07 6 0.2129528E-07 7 0.5106227E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.2995899E-14 1 0.7566520E-11 2 0.5579072E-10 3 0.4234915E-10 4 0.2113807E-10 5 0.1897509E-10 6 0.2839906E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.7104929E-15 1 0.1047929E-10 2 0.2374168E-10 3 0.1034218E-10 4 0.1426819E-10 5 0.8185859E-10 6 0.2561493E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.8485215E-11 1 0.2346361E-10 2 0.5976622E-10 3 0.1202330E-09 4 0.1944275E-09 5 0.1577471E-09 6 0.6395433E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.4886559E-14 1 0.1542227E-08 2 0.5225550E-09 3 0.1805320E-09 4 0.3410053E-09 5 0.3659840E-09 6 0.7091154E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.3428635E-14 1 0.8074736E-08 2 0.1414158E-08 3 0.2438651E-08 4 0.5358684E-08 5 0.8753442E-09 6 0.7395182E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.2686857E-07 1 0.1021502E-07 2 0.8832923E-08 3 0.4552849E-08 4 0.4974145E-08 5 0.2768956E-08 6 0.4123351E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.1404542E-13 1 0.1742241E-08 2 0.8855418E-07 3 0.6980318E-07 4 0.3054797E-07 5 0.9257541E-08 6 0.1244346E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.1166522E-12 1 0.1058783E-06 2 0.8418601E-06 3 0.6332341E-06 4 0.5628184E-07 5 0.3031732E-07 6 0.1305816E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.1786700E-07 1 0.1132619E-05 2 0.4332006E-05 3 0.3420874E-05 4 0.2794354E-06 5 0.4832078E-07 6 0.1813291E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.1601468E-17 1 0.4920762E-12 2 0.2186093E-11 3 0.6349453E-12 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.4115659E-12 1 0.1562863E-11 2 0.1500231E-11 3 0.3997279E-12 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.9622329E-18 1 0.5821657E-12 2 0.2752246E-11 3 0.9850841E-12 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.1888034E-17 1 0.7294528E-12 2 0.4992465E-12 3 0.1356750E-11 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.3557461E-12 1 0.8581873E-12 2 0.6421036E-11 3 0.9309881E-11 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.1087387E-16 1 0.2023434E-10 2 0.3981814E-09 3 0.2092715E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.6752177E-17 1 0.1435970E-09 2 0.1378591E-08 3 0.6395586E-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 0.2846608E-09 1 0.4892559E-09 2 0.1123911E-08 3 0.4151675E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.1279938E-16 1 0.7819528E-09 2 0.2453112E-08 3 0.9765444E-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 0.1435384E-15 1 0.5605314E-08 2 0.1993561E-07 3 0.3639277E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.2241347E-09 1 0.1005978E-07 2 0.2063529E-07 3 0.1008139E-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 0.1357544E-16 1 0.2047615E-06 2 0.6652422E-07 3 0.4985739E-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 0.1843562E-16 1 0.3498642E-07 2 0.1527026E-06 3 0.3092246E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9979075 average vibrational energy (ev) = 0.000007 average rotational energy (ev) = 0.494478 average diffraction energy (ev) = 0.051097 the reaction probability = 0.2092478D-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 0.9869493E+00 0.5517490E-01 0.4928614E+00 1 0.2384777E-03 0.3931840E-01 0.2158852E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.4109918E-04 0 31 2 -2 0.1622966E-04 0 37 2 -1 0.1578820E-04 0 44 2 0 0.1432572E-04 0 50 2 1 0.3758911E-04 0 56 2 2 0.1302910E-03 0 21 4 -4 0.1084538E-04 0 26 4 -3 0.8703958E-05 0 32 4 -2 0.3344902E-05 0 38 4 -1 0.1138026E-04 0 45 4 0 0.2637249E-04 0 51 4 1 0.6662224E-04 0 57 4 2 0.5959753E-04 0 62 4 3 0.2331147E-03 0 67 4 4 0.4544507E-03 0 13 6 -6 0.1976897E-05 0 17 6 -5 0.8228120E-06 0 22 6 -4 0.9273504E-07 0 27 6 -3 0.1400954E-06 0 33 6 -2 0.4357499E-06 0 39 6 -1 0.3224129E-05 0 46 6 0 0.2129315E-04 0 52 6 1 0.1281673E-03 0 58 6 2 0.4590032E-03 0 63 6 3 0.7883149E-03 0 68 6 4 0.6910820E-03 0 72 6 5 0.2143877E-02 0 76 6 6 0.4339037E-02 0 7 8 -8 0.1504356E-07 0 10 8 -7 0.5924458E-08 0 14 8 -6 0.1227302E-08 0 18 8 -5 0.5800232E-09 0 23 8 -4 0.2237003E-09 0 28 8 -3 0.9083201E-09 0 34 8 -2 0.9822768E-08 0 40 8 -1 0.8256350E-07 0 47 8 0 0.9725552E-06 0 53 8 1 0.2466218E-04 0 59 8 2 0.4944615E-03 0 64 8 3 0.6092223E-02 0 69 8 4 0.4206798E-01 0 73 8 5 0.1323484E+00 0 77 8 6 0.1494976E+00 0 80 8 7 0.2417223E+00 0 83 8 8 0.4049589E+00 0 3 10 -10 0.2126619E-10 0 5 10 -9 0.1232765E-10 0 8 10 -8 0.1281984E-10 0 11 10 -7 0.9844783E-11 0 15 10 -6 0.1110894E-10 0 19 10 -5 0.9045786E-11 0 24 10 -4 0.1993032E-10 0 29 10 -3 0.8002949E-10 0 35 10 -2 0.4943113E-09 0 41 10 -1 0.2104321E-08 0 48 10 0 0.6609877E-08 0 54 10 1 0.2056617E-07 0 60 10 2 0.5984776E-07 0 65 10 3 0.2298276E-06 0 70 10 4 0.6203975E-06 0 74 10 5 0.8695300E-06 0 78 10 6 0.8108677E-05 0 81 10 7 0.1671755E-04 0 84 10 8 0.3023469E-05 0 86 10 9 0.3076505E-05 0 88 10 10 0.1711810E-05 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.8085317E-06 1 31 2 -2 0.4784273E-06 1 37 2 -1 0.1017860E-06 1 44 2 0 0.7546687E-06 1 50 2 1 0.9422754E-06 1 56 2 2 0.3653879E-05 1 21 4 -4 0.1183358E-07 1 26 4 -3 0.9742205E-08 1 32 4 -2 0.1384999E-07 1 38 4 -1 0.1210611E-07 1 45 4 0 0.6963529E-07 1 51 4 1 0.2529266E-06 1 57 4 2 0.2597903E-05 1 62 4 3 0.1600671E-04 1 67 4 4 0.9358726E-04 1 13 6 -6 0.5369572E-11 1 17 6 -5 0.1308943E-10 1 22 6 -4 0.1353552E-10 1 27 6 -3 0.2696274E-10 1 33 6 -2 0.3020035E-09 1 39 6 -1 0.2071019E-08 1 46 6 0 0.2824198E-08 1 52 6 1 0.2726163E-08 1 58 6 2 0.9258211E-08 1 63 6 3 0.4900520E-07 1 68 6 4 0.5229473E-06 1 72 6 5 0.9475638E-05 1 76 6 6 0.1091113E-03 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 0.6520933E-11 1 0.3499308E-06 2 0.2016977E-05 3 0.1854698E-05 4 0.2882380E-05 5 0.1372271E-04 6 0.1379699E-04 7 0.5413066E-05 8 0.1021590E-05 9 0.4083560E-07 v, j, mj = 0 2 -2 0 0.1443661E-08 1 0.3775673E-06 2 0.6175841E-07 3 0.1584975E-05 4 0.2334411E-05 5 0.5526812E-05 6 0.4449366E-05 7 0.1661760E-05 8 0.2235974E-06 9 0.7972471E-08 v, j, mj = 0 2 -1 0 0.8357338E-12 1 0.4920380E-05 2 0.3384669E-05 3 0.3094224E-05 4 0.8796707E-06 5 0.1668490E-05 6 0.1399921E-05 7 0.3935072E-06 8 0.4410397E-07 9 0.3233254E-08 v, j, mj = 0 2 0 0 0.1425375E-11 1 0.2296244E-06 2 0.2124876E-05 3 0.1610744E-05 4 0.1680430E-05 5 0.3139168E-05 6 0.3362332E-05 7 0.1819636E-05 8 0.3431814E-06 9 0.1572609E-07 v, j, mj = 0 2 1 0 0.6651084E-06 1 0.1006256E-05 2 0.5567542E-05 3 0.5812692E-05 4 0.3658320E-05 5 0.7096025E-05 6 0.9689790E-05 7 0.3505518E-05 8 0.5749228E-06 9 0.1293981E-07 v, j, mj = 0 2 2 0 0.3386421E-11 1 0.6884370E-06 2 0.5768623E-05 3 0.9789537E-05 4 0.3649018E-05 5 0.3505936E-04 6 0.4801988E-04 7 0.2135994E-04 8 0.5588052E-05 9 0.3681640E-06 v, j, mj = 0 4 -4 0 0.5753114E-11 1 0.6999650E-07 2 0.1066253E-05 3 0.1025933E-05 4 0.3186450E-05 5 0.3269307E-05 6 0.1743184E-05 7 0.4503669E-06 8 0.3319183E-07 9 0.6883100E-09 v, j, mj = 0 4 -3 0 0.1896005E-11 1 0.2948890E-05 2 0.2689252E-05 3 0.1610038E-05 4 0.8009903E-06 5 0.4274328E-06 6 0.2023022E-06 7 0.2309015E-07 8 0.1471396E-08 9 0.4892773E-09 v, j, mj = 0 4 -2 0 0.9034635E-08 1 0.3053824E-06 2 0.2982034E-06 3 0.1287438E-05 4 0.8320554E-06 5 0.3751814E-06 6 0.1831640E-06 7 0.4509179E-07 8 0.8895450E-08 9 0.4550610E-09 v, j, mj = 0 4 -1 0 0.1388076E-11 1 0.3614182E-05 2 0.8683528E-06 3 0.4946223E-05 4 0.1486034E-05 5 0.3070327E-06 6 0.1014398E-06 7 0.4829851E-07 8 0.7794755E-08 9 0.8965549E-09 v, j, mj = 0 4 0 0 0.8459802E-12 1 0.1873022E-05 2 0.6659184E-05 3 0.1457988E-04 4 0.2191349E-05 5 0.8361647E-06 6 0.1477937E-06 7 0.7508278E-07 8 0.7498778E-08 9 0.2509582E-08 v, j, mj = 0 4 1 0 0.9821591E-05 1 0.3110788E-05 2 0.2692375E-04 3 0.1553149E-04 4 0.6425937E-05 5 0.2575898E-05 6 0.1598222E-05 7 0.5468253E-06 8 0.8546084E-07 9 0.2266676E-08 v, j, mj = 0 4 2 0 0.2344153E-11 1 0.6401963E-06 2 0.1992737E-04 3 0.1494439E-04 4 0.6782056E-05 5 0.7988519E-05 6 0.6948973E-05 7 0.2122960E-05 8 0.2307262E-06 9 0.1233677E-07 v, j, mj = 0 4 3 0 0.2895725E-11 1 0.1057191E-04 2 0.3664480E-04 3 0.7201975E-04 4 0.9492143E-05 5 0.3955296E-04 6 0.4919072E-04 7 0.1493844E-04 8 0.6969442E-06 9 0.7015452E-08 v, j, mj = 0 4 4 0 0.4071568E-07 1 0.6130681E-05 2 0.2094609E-04 3 0.3607029E-04 4 0.1261377E-04 5 0.1120301E-03 6 0.1762616E-03 7 0.8266920E-04 8 0.7637556E-05 9 0.5063388E-07 v, j, mj = 0 6 -6 0 0.1772687E-11 1 0.3218398E-07 2 0.1133339E-06 3 0.3310926E-06 4 0.6469800E-06 5 0.6008102E-06 6 0.2328983E-06 7 0.1930855E-07 8 0.1684042E-09 9 0.1191268E-09 v, j, mj = 0 6 -5 0 0.1229396E-06 1 0.1032775E-06 2 0.9209612E-07 3 0.8282065E-07 4 0.1931484E-06 5 0.1727772E-06 6 0.5288382E-07 7 0.2722571E-08 8 0.9458547E-10 9 0.5160985E-10 v, j, mj = 0 6 -4 0 0.1997253E-13 1 0.4007813E-08 2 0.2775477E-07 3 0.2473272E-07 4 0.2099559E-07 5 0.1283561E-07 6 0.1410459E-08 7 0.6727635E-09 8 0.2377637E-09 9 0.8751781E-10 v, j, mj = 0 6 -3 0 0.1461334E-12 1 0.2378179E-07 2 0.3585757E-07 3 0.3914620E-07 4 0.3437505E-07 5 0.4519597E-08 6 0.1234287E-08 7 0.5918380E-09 8 0.3306071E-09 9 0.2582844E-09 v, j, mj = 0 6 -2 0 0.1043851E-09 1 0.1183962E-07 2 0.3971959E-07 3 0.2063786E-06 4 0.1616710E-06 5 0.1229256E-07 6 0.1393901E-08 7 0.7942923E-09 8 0.1038587E-08 9 0.5174542E-09 v, j, mj = 0 6 -1 0 0.6051227E-12 1 0.5571331E-07 2 0.4458177E-06 3 0.1631558E-05 4 0.1048575E-05 5 0.2969923E-07 6 0.5610481E-08 7 0.4106044E-08 8 0.1982170E-08 9 0.1067293E-08 v, j, mj = 0 6 0 0 0.1280024E-12 1 0.2320802E-06 2 0.2614114E-05 3 0.1443310E-04 4 0.3878970E-05 5 0.1109188E-06 6 0.1216744E-07 7 0.3900087E-08 8 0.4717311E-08 9 0.3186015E-08 v, j, mj = 0 6 1 0 0.1416716E-05 1 0.8163385E-06 2 0.3418184E-04 3 0.8350896E-04 4 0.7526641E-05 5 0.5903474E-06 6 0.1000077E-06 7 0.1801864E-07 8 0.4540816E-08 9 0.3873916E-08 v, j, mj = 0 6 2 0 0.4132795E-12 1 0.3784513E-05 2 0.2478912E-03 3 0.1772012E-03 4 0.2277426E-04 5 0.6005131E-05 6 0.1237977E-05 7 0.8493027E-07 8 0.1082628E-07 9 0.1322277E-07 v, j, mj = 0 6 3 0 0.8997797E-11 1 0.6631117E-04 2 0.5133352E-03 3 0.1131469E-03 4 0.4997533E-04 5 0.3706730E-04 6 0.7743317E-05 7 0.6923458E-06 8 0.2102090E-07 9 0.2225540E-07 v, j, mj = 0 6 4 0 0.8160096E-06 1 0.1418769E-03 2 0.1463909E-03 3 0.1853361E-03 4 0.7844114E-04 5 0.1006274E-03 6 0.3357367E-04 7 0.3881050E-05 8 0.1137127E-06 9 0.2506557E-07 v, j, mj = 0 6 5 0 0.5613519E-11 1 0.2956803E-03 2 0.7411476E-03 3 0.4012217E-03 4 0.7882067E-04 5 0.4305484E-03 6 0.1800614E-03 7 0.1603413E-04 8 0.3342409E-06 9 0.2846129E-07 v, j, mj = 0 6 6 0 0.6622150E-11 1 0.1130815E-03 2 0.4320991E-03 3 0.5423078E-03 4 0.5562011E-03 5 0.1827177E-02 6 0.8013073E-03 7 0.6583374E-04 8 0.1001986E-05 9 0.2667726E-07 v, j, mj = 0 8 -8 0 0.6592321E-11 1 0.1417940E-09 2 0.9872234E-09 3 0.4797385E-08 4 0.7443001E-08 5 0.1578104E-08 6 0.5710055E-10 7 0.1457903E-10 8 0.1778413E-10 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.6435090E-13 1 0.2106165E-09 2 0.2733363E-09 3 0.2150067E-08 4 0.2569957E-08 5 0.6594169E-09 6 0.3734680E-10 7 0.1416811E-10 8 0.9484573E-11 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.5269727E-13 1 0.1005754E-09 2 0.1717014E-09 3 0.3230519E-09 4 0.4315514E-09 5 0.1476421E-09 6 0.1332320E-10 7 0.2928304E-10 8 0.1012069E-10 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1062295E-09 1 0.8405489E-11 2 0.1368522E-09 3 0.6797297E-10 4 0.1228549E-09 5 0.7041595E-10 6 0.2272315E-10 7 0.2898898E-10 8 0.1557999E-10 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.5722469E-13 1 0.4198739E-11 2 0.1343727E-10 3 0.3614862E-10 4 0.1719793E-10 5 0.1386763E-10 6 0.4369234E-10 7 0.6737111E-10 8 0.2772947E-10 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.3196310E-13 1 0.1589049E-10 2 0.2702647E-09 3 0.1011858E-09 4 0.2200321E-09 5 0.5307463E-10 6 0.3520668E-10 7 0.1457699E-09 8 0.6686386E-10 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.3577332E-10 1 0.8064521E-09 2 0.4680824E-08 3 0.1634381E-08 4 0.5499954E-09 5 0.6431483E-09 6 0.5215527E-09 7 0.6621195E-09 8 0.2885207E-09 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.4291359E-13 1 0.1498799E-07 2 0.3657223E-07 3 0.1071414E-07 4 0.1213771E-07 5 0.4248829E-08 6 0.1838818E-08 7 0.1346702E-08 8 0.7170403E-09 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.1578375E-13 1 0.7599335E-07 2 0.2026308E-06 3 0.2988099E-06 4 0.3544515E-06 5 0.2566677E-07 6 0.3830845E-08 7 0.8644446E-08 8 0.2527533E-08 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.1757235E-06 1 0.3304183E-06 2 0.2087239E-05 3 0.1464138E-04 4 0.6999992E-05 5 0.4002107E-06 6 0.1241340E-07 7 0.9837290E-08 8 0.4970850E-08 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.2121624E-12 1 0.7837683E-05 2 0.9787850E-04 3 0.2900802E-03 4 0.9222311E-04 5 0.6302119E-05 6 0.1048867E-06 7 0.3137737E-07 8 0.3624999E-08 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.9619957E-11 1 0.4087760E-04 2 0.2034852E-02 3 0.3107084E-02 4 0.8499219E-03 5 0.5833304E-04 6 0.1109009E-05 7 0.3806422E-07 8 0.7147354E-08 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.8136317E-06 1 0.1262267E-02 2 0.1626715E-01 3 0.1946867E-01 4 0.4732042E-02 5 0.3308300E-03 6 0.6125789E-05 7 0.7228659E-07 8 0.5430599E-08 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.7099604E-11 1 0.4143010E-02 2 0.5050729E-01 3 0.6205608E-01 4 0.1453077E-01 5 0.1087006E-02 6 0.2412166E-04 7 0.1472243E-06 8 0.4167114E-08 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.6246231E-14 1 0.1768848E-01 2 0.4192708E-01 3 0.7276825E-01 4 0.1556737E-01 5 0.1484090E-02 6 0.6199509E-04 7 0.2863392E-06 8 0.9019120E-08 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.3228405E-01 1 0.5998136E-01 2 0.7757181E-01 3 0.4890544E-01 4 0.1576540E-01 5 0.6919220E-02 6 0.2938105E-03 7 0.1194939E-05 8 0.1097612E-07 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.6017377E-12 1 0.6634356E-01 2 0.1462595E+00 3 0.3433924E-01 4 0.1101012E+00 5 0.4616463E-01 6 0.1744911E-02 7 0.5850135E-05 8 0.1353232E-07 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.2099046E-13 1 0.4021905E-11 2 0.4264167E-11 3 0.2581244E-11 4 0.4486286E-11 5 0.5891592E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.7079678E-14 1 0.2218796E-12 2 0.1347321E-11 3 0.1967266E-11 4 0.4236268E-11 5 0.4547834E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.7478540E-13 1 0.5623100E-13 2 0.1202878E-11 3 0.7630516E-12 4 0.3892009E-11 5 0.6830888E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.7305059E-15 1 0.6665305E-13 2 0.3343955E-12 3 0.2574764E-11 4 0.4810428E-11 5 0.2057813E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.2118777E-15 1 0.7378354E-12 2 0.1514102E-11 3 0.2835585E-11 4 0.1225714E-11 5 0.4795491E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.6130482E-12 1 0.1495772E-12 2 0.1154584E-11 3 0.3155573E-11 4 0.2315231E-11 5 0.1657771E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.4136843E-16 1 0.1163938E-11 2 0.2196380E-11 3 0.6123917E-11 4 0.5010173E-11 5 0.5435875E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.3075375E-17 1 0.4243111E-11 2 0.6299425E-11 3 0.1444058E-10 4 0.2375660E-10 5 0.3128977E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.2482504E-12 1 0.4792491E-10 2 0.5520635E-10 3 0.8806448E-10 4 0.1030713E-09 5 0.1997960E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.3360701E-17 1 0.1228279E-10 2 0.2852503E-09 3 0.8214315E-09 4 0.3801551E-09 5 0.6052013E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.3073982E-17 1 0.3188256E-09 2 0.5183727E-09 3 0.1977307E-08 4 0.1137527E-08 5 0.2657844E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.3294914E-09 1 0.2516205E-09 2 0.2756306E-08 3 0.5623393E-08 4 0.6428234E-08 5 0.5177121E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.5253678E-16 1 0.2136866E-08 2 0.1104166E-07 3 0.1682718E-07 4 0.1263319E-07 5 0.1720887E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.1219110E-14 1 0.1849951E-07 2 0.9991888E-07 3 0.3436260E-07 4 0.3996687E-07 5 0.3707975E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.3899752E-08 1 0.2027949E-07 2 0.1907159E-06 3 0.2755525E-06 4 0.7457734E-07 5 0.5537244E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.1480900E-14 1 0.5689219E-08 2 0.4032933E-06 3 0.3214232E-06 4 0.1081056E-06 5 0.3101870E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.2448550E-15 1 0.5303736E-05 2 0.2509562E-05 3 0.2141062E-06 4 0.4076424E-07 5 0.4050841E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.1499506E-05 1 0.8806839E-05 2 0.5603372E-05 3 0.5003853E-06 4 0.2291486E-06 5 0.7829719E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.9150165E-15 1 0.6105548E-06 2 0.1593056E-05 3 0.6400837E-06 4 0.1096876E-06 5 0.7008656E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.2030167E-12 1 0.1504176E-06 2 0.1033496E-05 3 0.1650877E-05 4 0.1458571E-06 5 0.9585682E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.5380373E-07 1 0.2497466E-06 2 0.5035266E-06 3 0.3193082E-06 4 0.4374183E-06 5 0.1480065E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.5726743E-12 1 0.1578738E-07 2 0.7496460E-07 3 0.3158935E-06 4 0.3325224E-06 5 0.5907616E-07 6 0.5386936E-08 7 0.4733160E-08 8 0.1669268E-09 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.3773239E-09 1 0.1173816E-07 2 0.2796449E-07 3 0.1283345E-06 4 0.2728880E-06 5 0.3565105E-07 6 0.7942195E-09 7 0.6796154E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.2689317E-12 1 0.1189406E-07 2 0.7087970E-08 3 0.3585441E-07 4 0.4149501E-07 5 0.4065422E-08 6 0.4544028E-09 7 0.9344034E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.4788859E-12 1 0.3093774E-08 2 0.5463122E-07 3 0.3507130E-06 4 0.3132023E-06 5 0.2688454E-07 6 0.4148573E-08 7 0.1994851E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.5213942E-07 1 0.8537527E-07 2 0.1268793E-06 3 0.1814244E-06 4 0.4416482E-06 5 0.4607146E-07 6 0.4447358E-08 7 0.4289986E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.3606648E-12 1 0.1167611E-06 2 0.1312805E-05 3 0.1011077E-05 4 0.7081670E-06 5 0.4515635E-06 6 0.5122318E-07 7 0.2281277E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.3828005E-14 1 0.1704229E-08 2 0.3345302E-09 3 0.7457239E-08 4 0.2180968E-08 5 0.5635927E-10 6 0.1002555E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.1203123E-12 1 0.1589361E-09 2 0.3506481E-08 3 0.5279828E-08 4 0.6483151E-09 5 0.7520408E-10 6 0.7332085E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.1233236E-10 1 0.1463963E-08 2 0.3269278E-08 3 0.3586080E-08 4 0.5079132E-08 5 0.2442158E-09 6 0.1949935E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.6392368E-13 1 0.4275463E-08 2 0.1881483E-08 3 0.3781455E-08 4 0.1742986E-08 5 0.3455975E-09 6 0.7906561E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.3615216E-13 1 0.1052540E-07 2 0.2969211E-08 3 0.3337143E-07 4 0.1992026E-07 5 0.1599987E-08 6 0.1248972E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.8008676E-07 1 0.3383156E-07 2 0.1564376E-07 3 0.8914798E-07 4 0.2825814E-07 5 0.3716768E-08 6 0.2241657E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.1972430E-12 1 0.1325424E-06 2 0.1237264E-05 3 0.9895802E-06 4 0.2139178E-06 5 0.1840637E-07 6 0.6191292E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.2386613E-11 1 0.1479623E-06 2 0.6327922E-05 3 0.7031935E-05 4 0.2370780E-05 5 0.1186675E-06 6 0.9437908E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.6329608E-07 1 0.1367603E-04 2 0.6460439E-05 3 0.5778288E-04 4 0.1519990E-04 5 0.3720801E-06 6 0.3264268E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.1077487E-13 1 0.7598450E-13 2 0.5645401E-12 3 0.8968797E-12 4 0.3821393E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.2431508E-12 1 0.1991066E-11 2 0.7228473E-11 3 0.2012738E-11 4 0.1614004E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.1767787E-16 1 0.1669658E-11 2 0.4693578E-11 3 0.3160635E-11 4 0.4011628E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.1178162E-15 1 0.5089123E-11 2 0.5506842E-11 3 0.5383975E-11 4 0.1098268E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.2569775E-11 1 0.1067281E-10 2 0.2281804E-10 3 0.1463567E-09 4 0.1195861E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.6854455E-15 1 0.7878966E-11 2 0.2776991E-09 3 0.9899413E-09 4 0.7954985E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.1143406E-15 1 0.1849079E-10 2 0.6199810E-09 3 0.1286131E-08 4 0.8995952E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.4897156E-09 1 0.2953572E-09 2 0.5632084E-09 3 0.6580002E-09 4 0.7198819E-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 0.5372875E-15 1 0.9447205E-09 2 0.4518395E-08 3 0.2157856E-08 4 0.1637239E-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 0.7649633E-14 1 0.1022603E-07 2 0.2863982E-07 3 0.5270129E-08 4 0.4869209E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.8887723E-08 1 0.7758144E-07 2 0.3424205E-06 3 0.6312969E-07 4 0.3092794E-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 0.2130827E-13 1 0.3072298E-05 2 0.5194812E-05 3 0.1159570E-05 4 0.4895793E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.1044223E-13 1 0.5889740E-04 2 0.4605133E-04 3 0.4071237E-05 4 0.9134155E-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 = 0.9871877 average vibrational energy (ev) = 0.000123 average rotational energy (ev) = 0.492795 average diffraction energy (ev) = 0.055171 the reaction probability = 0.1281226D-01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.38986810D+01 trans energy = 0.49285714D+00 trans energy in z = 0.49285714D+00 total momentum = 0.11536724D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.8710084E+00 0.5598391E-01 0.4865933E+00 1 0.2353995E-01 0.2398040E-01 0.2872794E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.3302705E-03 0 31 2 -2 0.1969359E-03 0 37 2 -1 0.9688410E-04 0 44 2 0 0.1142825E-03 0 50 2 1 0.2310999E-03 0 56 2 2 0.8317883E-03 0 21 4 -4 0.1106693E-03 0 26 4 -3 0.6014992E-04 0 32 4 -2 0.3122894E-04 0 38 4 -1 0.1014787E-03 0 45 4 0 0.1274948E-03 0 51 4 1 0.3728904E-03 0 57 4 2 0.2848700E-03 0 62 4 3 0.1114773E-02 0 67 4 4 0.2287241E-02 0 13 6 -6 0.4210417E-04 0 17 6 -5 0.1394474E-04 0 22 6 -4 0.1506096E-05 0 27 6 -3 0.1587803E-05 0 33 6 -2 0.5444222E-05 0 39 6 -1 0.3003601E-04 0 46 6 0 0.1270860E-03 0 52 6 1 0.5782936E-03 0 58 6 2 0.1480099E-02 0 63 6 3 0.1740450E-02 0 68 6 4 0.1864947E-02 0 72 6 5 0.6717222E-02 0 76 6 6 0.1223678E-01 0 7 8 -8 0.1440413E-05 0 10 8 -7 0.4399189E-06 0 14 8 -6 0.9164263E-07 0 18 8 -5 0.3506895E-07 0 23 8 -4 0.1433066E-07 0 28 8 -3 0.1783589E-07 0 34 8 -2 0.6970179E-07 0 40 8 -1 0.6406855E-06 0 47 8 0 0.1194271E-04 0 53 8 1 0.2184275E-03 0 59 8 2 0.2703015E-02 0 64 8 3 0.2023792E-01 0 69 8 4 0.7999907E-01 0 73 8 5 0.1285501E+00 0 77 8 6 0.1034954E+00 0 80 8 7 0.2457183E+00 0 83 8 8 0.2587877E+00 0 3 10 -10 0.2474768E-09 0 5 10 -9 0.5208890E-10 0 8 10 -8 0.3169769E-10 0 11 10 -7 0.3619990E-10 0 15 10 -6 0.4988121E-10 0 19 10 -5 0.4061798E-10 0 24 10 -4 0.1387072E-09 0 29 10 -3 0.4626146E-09 0 35 10 -2 0.2231150E-08 0 41 10 -1 0.6004983E-08 0 48 10 0 0.1435213E-07 0 54 10 1 0.8360003E-07 0 60 10 2 0.4357776E-06 0 65 10 3 0.1510919E-05 0 70 10 4 0.1421199E-05 0 74 10 5 0.4884353E-05 0 78 10 6 0.3152288E-04 0 81 10 7 0.8103800E-04 0 84 10 8 0.1488932E-04 0 86 10 9 0.1058659E-04 0 88 10 10 0.5818429E-05 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.1858888E-04 1 31 2 -2 0.9200087E-05 1 37 2 -1 0.3875220E-05 1 44 2 0 0.1187553E-04 1 50 2 1 0.2524118E-04 1 56 2 2 0.9539175E-04 1 21 4 -4 0.2551059E-05 1 26 4 -3 0.1186936E-05 1 32 4 -2 0.4472739E-06 1 38 4 -1 0.5721091E-06 1 45 4 0 0.1161402E-05 1 51 4 1 0.8572619E-05 1 57 4 2 0.5677206E-04 1 62 4 3 0.2569115E-03 1 67 4 4 0.5889169E-03 1 13 6 -6 0.2578845E-08 1 17 6 -5 0.2738860E-08 1 22 6 -4 0.2387608E-08 1 27 6 -3 0.1155116E-08 1 33 6 -2 0.1809503E-08 1 39 6 -1 0.2412750E-08 1 46 6 0 0.5055405E-08 1 52 6 1 0.3042695E-07 1 58 6 2 0.9230143E-07 1 63 6 3 0.1108043E-05 1 68 6 4 0.2940592E-04 1 72 6 5 0.5779435E-03 1 76 6 6 0.2185007E-01 1 7 8 -8 0.3730433E-13 1 10 8 -7 0.1907209E-13 1 14 8 -6 0.3419493E-13 1 18 8 -5 0.2809635E-12 1 23 8 -4 0.7734341E-14 1 28 8 -3 0.1555797E-13 1 34 8 -2 0.5278972E-13 1 40 8 -1 0.8478517E-13 1 47 8 0 0.7985937E-13 1 53 8 1 0.4382091E-11 1 59 8 2 0.3758128E-11 1 64 8 3 0.3721597E-11 1 69 8 4 0.3664913E-09 1 73 8 5 0.7773641E-10 1 77 8 6 0.1883683E-09 1 80 8 7 0.8555801E-08 1 83 8 8 0.8305791E-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 0.5715859E-11 1 0.7078293E-05 2 0.1719730E-04 3 0.1466096E-04 4 0.7922840E-05 5 0.7147219E-04 6 0.1231391E-03 7 0.6986122E-04 8 0.1764030E-04 9 0.1298334E-05 v, j, mj = 0 2 -2 0 0.5711082E-07 1 0.4649117E-05 2 0.1625074E-05 3 0.1428918E-04 4 0.1082961E-04 5 0.6089719E-04 6 0.6461618E-04 7 0.3295920E-04 8 0.6643234E-05 9 0.3699875E-06 v, j, mj = 0 2 -1 0 0.6517425E-11 1 0.2724561E-04 2 0.1880800E-04 3 0.1588366E-04 4 0.3295873E-05 5 0.1182749E-04 6 0.1263826E-04 7 0.6197419E-05 8 0.9509843E-06 9 0.3678699E-07 v, j, mj = 0 2 0 0 0.1634021E-11 1 0.2401674E-05 2 0.1394676E-04 3 0.8599340E-05 4 0.5907523E-05 5 0.1790472E-04 6 0.3535686E-04 7 0.2315934E-04 8 0.6498590E-05 9 0.5076462E-06 v, j, mj = 0 2 1 0 0.2286750E-05 1 0.2685328E-05 2 0.1108598E-04 3 0.2908039E-04 4 0.3333336E-04 5 0.4151508E-04 6 0.6546027E-04 7 0.3769042E-04 8 0.7645167E-05 9 0.3171385E-06 v, j, mj = 0 2 2 0 0.1772214E-10 1 0.7414590E-05 2 0.2077397E-04 3 0.5236899E-04 4 0.1154231E-04 5 0.1520888E-03 6 0.3082831E-03 7 0.2065517E-03 8 0.6638887E-04 9 0.6375989E-05 v, j, mj = 0 4 -4 0 0.6117882E-10 1 0.4119671E-06 2 0.8183572E-05 3 0.6549759E-05 4 0.2091651E-04 5 0.3863834E-04 6 0.2659149E-04 7 0.8419806E-05 8 0.9376123E-06 9 0.2016049E-07 v, j, mj = 0 4 -3 0 0.2390859E-11 1 0.2352320E-04 2 0.1719629E-04 3 0.1067095E-04 4 0.3572420E-05 5 0.2846049E-05 6 0.1807223E-05 7 0.4832942E-06 8 0.4857282E-07 9 0.1916896E-08 v, j, mj = 0 4 -2 0 0.3810885E-07 1 0.4717124E-05 2 0.1905559E-05 3 0.7571212E-05 4 0.9021531E-05 5 0.3770607E-05 6 0.2867876E-05 7 0.1110348E-05 8 0.2181215E-06 9 0.8448667E-08 v, j, mj = 0 4 -1 0 0.9732971E-11 1 0.3424656E-04 2 0.1487500E-04 3 0.3345083E-04 4 0.1327734E-04 5 0.3354111E-05 6 0.1367928E-05 7 0.7672848E-06 8 0.1324681E-06 9 0.7189546E-08 v, j, mj = 0 4 0 0 0.1788708E-12 1 0.5530977E-05 2 0.2931499E-04 3 0.6523941E-04 4 0.2119898E-04 5 0.2818134E-05 6 0.2008516E-05 7 0.1151355E-05 8 0.2211674E-06 9 0.1124419E-07 v, j, mj = 0 4 1 0 0.4408007E-04 1 0.2445997E-04 2 0.1423322E-03 3 0.5883663E-04 4 0.5634711E-04 5 0.2274638E-04 6 0.1565463E-04 7 0.7190647E-05 8 0.1209483E-05 9 0.3332583E-07 v, j, mj = 0 4 2 0 0.1110206E-12 1 0.5200169E-05 2 0.6640812E-04 3 0.9472684E-04 4 0.2716452E-04 5 0.2723577E-04 6 0.4054450E-04 7 0.2010386E-04 8 0.3353979E-05 9 0.1322015E-06 v, j, mj = 0 4 3 0 0.5334617E-11 1 0.4185431E-04 2 0.1165385E-03 3 0.2691196E-03 4 0.1143658E-03 5 0.1326969E-03 6 0.2752023E-03 7 0.1488709E-03 8 0.1598302E-04 9 0.1417488E-06 v, j, mj = 0 4 4 0 0.2501246E-06 1 0.2959510E-04 2 0.5728512E-04 3 0.1811010E-03 4 0.3745700E-04 5 0.3384061E-03 6 0.9275078E-03 7 0.6080011E-03 8 0.1053523E-03 9 0.2285253E-05 v, j, mj = 0 6 -6 0 0.8792571E-11 1 0.7865180E-06 2 0.4285204E-05 3 0.2911174E-05 4 0.1041890E-04 5 0.1435507E-04 6 0.7940581E-05 7 0.1374840E-05 8 0.3171617E-07 9 0.1507980E-09 v, j, mj = 0 6 -5 0 0.2477955E-05 1 0.2277342E-05 2 0.4220438E-05 3 0.6333705E-06 4 0.8528557E-06 5 0.2187796E-05 6 0.1169411E-05 7 0.1234271E-06 8 0.1919833E-08 9 0.2268728E-09 v, j, mj = 0 6 -4 0 0.2756156E-11 1 0.7279183E-07 2 0.3410903E-06 3 0.1805942E-06 4 0.4171548E-06 5 0.3204064E-06 6 0.1413426E-06 7 0.3003218E-07 8 0.2373744E-08 9 0.3067475E-09 v, j, mj = 0 6 -3 0 0.5859715E-13 1 0.4573872E-07 2 0.9571085E-07 3 0.5068630E-06 4 0.8686594E-06 5 0.3894352E-07 6 0.2419887E-07 7 0.6312029E-08 8 0.1048984E-08 9 0.3279272E-09 v, j, mj = 0 6 -2 0 0.2703340E-08 1 0.6586306E-06 2 0.7417440E-07 3 0.2655726E-05 4 0.1891597E-05 5 0.1326210E-06 6 0.2030779E-07 7 0.5675975E-08 8 0.2335656E-08 9 0.4510059E-09 v, j, mj = 0 6 -1 0 0.2508022E-11 1 0.3496398E-05 2 0.3890661E-05 3 0.1371138E-04 4 0.8708848E-05 5 0.1909620E-06 6 0.2325803E-07 7 0.1098169E-07 8 0.2400602E-08 9 0.1114227E-08 v, j, mj = 0 6 0 0 0.9546208E-12 1 0.1337397E-05 2 0.1890210E-04 3 0.9118171E-04 4 0.1511941E-04 5 0.4836625E-06 6 0.4666987E-07 7 0.8757009E-08 8 0.4727372E-08 9 0.1594335E-08 v, j, mj = 0 6 1 0 0.1362329E-04 1 0.7110903E-05 2 0.1894178E-03 3 0.3515857E-03 4 0.1309751E-04 5 0.2627200E-05 6 0.6919171E-06 7 0.1228808E-06 8 0.1195205E-07 9 0.4373484E-08 v, j, mj = 0 6 2 0 0.1094422E-11 1 0.2652625E-04 2 0.9915093E-03 3 0.3544261E-03 4 0.6733022E-04 5 0.3281930E-04 6 0.6720681E-05 7 0.7414149E-06 8 0.1795409E-07 9 0.7869954E-08 v, j, mj = 0 6 3 0 0.1966594E-10 1 0.2449134E-03 2 0.1051882E-02 3 0.1346174E-03 4 0.1409237E-03 5 0.1171533E-03 6 0.4351880E-04 7 0.7169872E-05 8 0.2500234E-06 9 0.2121416E-07 v, j, mj = 0 6 4 0 0.5950972E-06 1 0.2006968E-03 2 0.4773770E-03 3 0.6588201E-03 4 0.5581297E-04 5 0.2443626E-03 6 0.1932142E-03 7 0.3270975E-04 8 0.1316235E-05 9 0.4191904E-07 v, j, mj = 0 6 5 0 0.5863341E-10 1 0.8576616E-03 2 0.1810697E-02 3 0.1678556E-02 4 0.1402063E-03 5 0.1135851E-02 6 0.9511251E-03 7 0.1388850E-03 8 0.4144834E-05 9 0.9493114E-07 v, j, mj = 0 6 6 0 0.7011904E-10 1 0.4321145E-03 2 0.1291721E-02 3 0.1799942E-02 4 0.6950741E-03 5 0.3945829E-02 6 0.3426207E-02 7 0.6285105E-03 8 0.1730541E-04 9 0.7369798E-07 v, j, mj = 0 8 -8 0 0.1273700E-08 1 0.7493796E-07 2 0.8185734E-08 3 0.1736306E-06 4 0.6678261E-06 5 0.4704097E-06 6 0.4356909E-07 7 0.5509358E-09 8 0.2905868E-10 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.4651084E-11 1 0.2439595E-07 2 0.3101994E-07 3 0.6440665E-07 4 0.1934152E-06 5 0.1144220E-06 6 0.1206646E-07 7 0.1609347E-09 8 0.2705632E-10 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.1587873E-11 1 0.1471972E-07 2 0.2710674E-07 3 0.1729663E-07 4 0.2237903E-07 5 0.9126074E-08 6 0.9328331E-09 7 0.5874271E-10 8 0.2126476E-10 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1148432E-07 1 0.2722609E-08 2 0.3505980E-08 3 0.1070292E-07 4 0.4313041E-08 5 0.1762546E-08 6 0.4675665E-09 7 0.5135897E-10 8 0.5860937E-10 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.5857105E-12 1 0.5625617E-09 2 0.4628617E-08 3 0.6935700E-08 4 0.1499191E-08 5 0.3576912E-09 6 0.2159135E-09 7 0.9845573E-10 8 0.3193995E-10 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.1670487E-12 1 0.3024189E-08 2 0.4746802E-08 3 0.5562495E-08 4 0.3703496E-08 5 0.3734416E-09 6 0.1707281E-09 7 0.1563121E-09 8 0.9825785E-10 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.3433345E-09 1 0.7514205E-08 2 0.2295528E-07 3 0.2324082E-07 4 0.8778805E-08 5 0.3859010E-08 6 0.1447775E-08 7 0.1103706E-08 8 0.4588582E-09 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.3516791E-12 1 0.1383599E-07 2 0.1765763E-06 3 0.2084698E-06 4 0.2115525E-06 5 0.2573523E-07 6 0.1734844E-08 7 0.1619011E-08 8 0.1161444E-08 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.7905430E-13 1 0.1218405E-06 2 0.1712228E-05 3 0.5736210E-05 4 0.4130587E-05 5 0.2246786E-06 6 0.5460200E-08 7 0.8062836E-08 8 0.3644144E-08 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.3011144E-05 1 0.2151073E-05 2 0.2538737E-04 3 0.1400468E-03 4 0.4523624E-04 5 0.2539916E-05 6 0.3470457E-07 7 0.1208639E-07 8 0.8176149E-08 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.1504364E-11 1 0.5606071E-04 2 0.7254206E-03 3 0.1556269E-02 4 0.3429252E-03 5 0.2179861E-04 6 0.5056974E-06 7 0.2814271E-07 8 0.7598078E-08 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.5204069E-10 1 0.1519474E-03 2 0.9043086E-02 3 0.9103053E-02 4 0.1806926E-02 5 0.1291982E-03 6 0.3623021E-05 7 0.6760390E-07 8 0.1695745E-07 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.7356981E-05 1 0.4698700E-02 2 0.3857231E-01 3 0.3062296E-01 4 0.5618466E-02 5 0.4612655E-03 6 0.1776743E-04 7 0.2221250E-06 8 0.1606017E-07 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.3306170E-10 1 0.6311671E-02 2 0.6263410E-01 3 0.4914008E-01 4 0.9430877E-02 5 0.9700690E-03 6 0.6226512E-04 7 0.1008987E-05 8 0.2127759E-07 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.3964273E-11 1 0.2567129E-01 2 0.3570256E-01 3 0.3721183E-01 4 0.2587638E-02 5 0.2025898E-02 6 0.2914188E-03 7 0.4756782E-05 8 0.3667643E-07 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.4607794E-01 1 0.3623387E-01 2 0.7161597E-01 3 0.4121437E-01 4 0.2779548E-01 5 0.2089151E-01 6 0.1867031E-02 7 0.2211328E-04 8 0.1856160E-07 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.3928344E-10 1 0.6531581E-01 2 0.9099007E-01 3 0.1281892E-01 4 0.3303906E-01 5 0.5015798E-01 6 0.6394026E-02 7 0.7179849E-04 8 0.4783932E-07 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.1414340E-12 1 0.3677788E-10 2 0.1540948E-09 3 0.3821259E-10 4 0.6217370E-11 5 0.8310358E-11 6 0.3722434E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.1204948E-13 1 0.1491899E-10 2 0.1149190E-10 3 0.5437940E-11 4 0.1257604E-10 5 0.5672383E-11 6 0.1979597E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.2179673E-12 1 0.2522201E-11 2 0.4220446E-11 3 0.7433020E-11 4 0.6373321E-11 5 0.9086201E-11 6 0.1844532E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.9546087E-14 1 0.6568392E-12 2 0.3393945E-11 3 0.7547748E-11 4 0.1202207E-10 5 0.9775052E-11 6 0.2794697E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.8233288E-14 1 0.8052927E-11 2 0.6663550E-11 3 0.4949419E-11 4 0.1085821E-10 5 0.9123289E-11 6 0.1022558E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.3488145E-11 1 0.5621620E-12 2 0.6014359E-11 3 0.9996321E-11 4 0.7503772E-11 5 0.1163834E-10 6 0.1414874E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.2603472E-14 1 0.1693834E-10 2 0.2594144E-10 3 0.4721338E-10 4 0.2567304E-10 5 0.1916300E-10 6 0.3775414E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.8170654E-15 1 0.6689566E-11 2 0.2003501E-10 3 0.1532474E-09 4 0.1690514E-09 5 0.1024244E-09 6 0.1116594E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.4999527E-11 1 0.2745039E-09 2 0.4254179E-09 3 0.4956186E-09 4 0.5353499E-09 5 0.4076341E-09 6 0.8762578E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.3834054E-15 1 0.1758951E-09 2 0.1448445E-08 3 0.2336755E-08 4 0.6826159E-09 5 0.1221838E-08 6 0.1394340E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.7440394E-16 1 0.1378469E-08 2 0.1494666E-08 3 0.3536352E-08 4 0.2346323E-08 5 0.4830157E-08 6 0.7661651E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.5362120E-08 1 0.3204890E-08 2 0.1481897E-07 3 0.2544872E-07 4 0.2046571E-07 5 0.1272401E-07 6 0.1575602E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.1900864E-15 1 0.1974433E-07 2 0.1559511E-06 3 0.2048072E-06 4 0.3612537E-07 5 0.1371431E-07 6 0.5435224E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.1901227E-13 1 0.4167397E-07 2 0.8262004E-06 3 0.4915896E-06 4 0.1075303E-06 5 0.3792120E-07 6 0.6003318E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.8329790E-08 1 0.1006978E-06 2 0.5903974E-06 3 0.5361438E-06 4 0.1373753E-06 5 0.4120453E-07 6 0.7050407E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.9193433E-14 1 0.1271112E-05 2 0.2500720E-05 3 0.9460742E-06 4 0.1328806E-06 5 0.2055834E-07 6 0.1300843E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.6117140E-14 1 0.1540241E-04 2 0.1356965E-04 3 0.2404314E-05 4 0.1058870E-06 5 0.1858461E-07 6 0.2204681E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.2822807E-05 1 0.3976383E-04 2 0.3078916E-04 3 0.6786431E-05 4 0.7909521E-06 5 0.4472136E-07 6 0.4009106E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.5737519E-13 1 0.1306812E-05 2 0.1084495E-04 3 0.2280689E-05 4 0.3887683E-06 5 0.5752413E-07 6 0.1056998E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.1648830E-11 1 0.1615826E-05 2 0.3651812E-05 3 0.4674351E-05 4 0.5503732E-06 5 0.5751041E-07 6 0.3671402E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.8315119E-07 1 0.6207176E-06 2 0.2442041E-05 3 0.1989575E-05 4 0.3387105E-06 5 0.3048031E-06 6 0.3943082E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.1457989E-11 1 0.8896662E-07 2 0.1889887E-05 3 0.4468271E-05 4 0.9831245E-05 5 0.1837966E-05 6 0.4555471E-06 7 0.1650827E-07 8 0.4922690E-09 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.1471204E-07 1 0.7869387E-06 2 0.8535345E-06 3 0.2358133E-05 4 0.4129140E-05 5 0.9951986E-06 6 0.5975115E-07 7 0.2443978E-08 8 0.2353437E-09 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.6608414E-11 1 0.1098360E-05 2 0.9527342E-06 3 0.6515432E-06 4 0.8281361E-06 5 0.3229355E-06 6 0.2054382E-07 7 0.8159210E-09 8 0.1440484E-09 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.7840830E-11 1 0.1134304E-06 2 0.2560253E-05 3 0.4444330E-05 4 0.3699987E-05 5 0.8395442E-06 6 0.2072587E-06 7 0.1013890E-07 8 0.5791097E-09 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.8509850E-07 1 0.3404892E-06 2 0.5202641E-05 3 0.7046106E-05 4 0.7967738E-05 5 0.4511663E-05 6 0.8182839E-07 7 0.5008589E-08 8 0.6131189E-09 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.1714146E-10 1 0.4351240E-06 2 0.1389239E-04 3 0.2439856E-04 4 0.2221862E-04 5 0.3077459E-04 6 0.3642828E-05 7 0.2640715E-07 8 0.3214906E-08 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.1995854E-11 1 0.5482645E-08 2 0.4328699E-07 3 0.9561541E-06 4 0.1426690E-05 5 0.1183986E-06 6 0.1001594E-08 7 0.4335079E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.2710129E-11 1 0.5760560E-07 2 0.5373982E-07 3 0.7629429E-06 4 0.2997773E-06 5 0.1251370E-07 6 0.2931709E-09 7 0.6119110E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.1608965E-08 1 0.4110874E-07 2 0.1318636E-06 3 0.1154964E-06 4 0.1331340E-06 5 0.2271566E-07 6 0.1252137E-08 7 0.9435210E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.1472591E-11 1 0.2845141E-06 2 0.1990885E-06 3 0.2873793E-07 4 0.3844201E-07 5 0.2052383E-07 6 0.5476522E-09 7 0.2536440E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.1681123E-11 1 0.1782810E-06 2 0.2874274E-06 3 0.6206342E-06 4 0.6337657E-07 5 0.9543485E-08 6 0.1606111E-08 7 0.5320596E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.5583108E-06 1 0.1639758E-06 2 0.2327641E-05 3 0.3388572E-05 4 0.1800385E-05 5 0.3262767E-06 6 0.6698598E-08 7 0.7579806E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.7174219E-11 1 0.3535093E-06 2 0.2524676E-04 3 0.2555051E-04 4 0.4702084E-05 5 0.8864485E-06 6 0.3007263E-07 7 0.2661341E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.2589134E-10 1 0.1036555E-05 2 0.8504670E-04 3 0.1300057E-03 4 0.3734828E-04 5 0.3400906E-05 6 0.7278839E-07 7 0.5766509E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.3606697E-06 1 0.5585059E-04 2 0.4941072E-04 3 0.1429110E-03 4 0.3076574E-03 5 0.3249292E-04 6 0.2298800E-06 7 0.3767828E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.2739371E-11 1 0.1583163E-08 2 0.6047961E-09 3 0.3406556E-09 4 0.3656068E-10 5 0.1093038E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.7920289E-09 1 0.3487536E-09 2 0.9204886E-09 3 0.5807422E-09 4 0.8182115E-10 5 0.1502523E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.4022159E-12 1 0.2696723E-09 2 0.3226544E-09 3 0.1458817E-08 4 0.3272276E-09 5 0.8835118E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.2162900E-13 1 0.1578924E-09 2 0.1307570E-09 3 0.6780590E-09 4 0.1700365E-09 5 0.1834968E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.2422896E-12 1 0.4917178E-10 2 0.5929847E-09 3 0.7565617E-09 4 0.3377531E-09 5 0.7278976E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.5094381E-13 1 0.3113961E-09 2 0.5505456E-09 3 0.5917641E-09 4 0.7127138E-09 5 0.2462792E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.4600603E-14 1 0.1309395E-08 2 0.7658114E-09 3 0.2339699E-08 4 0.3933097E-09 5 0.2471855E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.4348142E-08 1 0.4354469E-08 2 0.1278942E-07 3 0.5940677E-08 4 0.1801931E-08 5 0.1192306E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.2703699E-13 1 0.7504439E-08 2 0.4116403E-07 3 0.3216863E-07 4 0.8794869E-08 5 0.2669437E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.3677489E-12 1 0.9947146E-07 2 0.6536286E-06 3 0.3168189E-06 4 0.2723423E-07 5 0.1088918E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.1803597E-06 1 0.2293249E-05 2 0.1591252E-04 3 0.1038750E-04 4 0.6083186E-06 5 0.2397144E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.3686285E-10 1 0.6949992E-04 2 0.3660375E-03 3 0.1367999E-03 4 0.5564429E-05 5 0.4172146E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.2861168E-11 1 0.9945432E-02 2 0.1046549E-01 3 0.1414820E-02 4 0.2426242E-04 5 0.6689592E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -8 0 0.2524186E-13 1 0.1206247E-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 0.1183462E-15 1 0.1895375E-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 0.2366310E-16 1 0.3417127E-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 -5 0 0.2687585E-12 1 0.1220503E-13 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -4 0 0.1804622E-17 1 0.7732536E-14 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -3 0 0.1255056E-17 1 0.1555671E-13 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -2 0 0.2824409E-13 1 0.2454563E-13 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -1 0 0.6950493E-18 1 0.8478448E-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 0 0 0.1164200E-17 1 0.7985821E-13 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 1 0 0.3843807E-11 1 0.5382833E-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 0.8214903E-17 1 0.3758120E-11 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 3 0 0.3824539E-17 1 0.3721593E-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 4 0 0.3554551E-09 1 0.1103617E-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 0.7224263E-16 1 0.7773634E-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 0.3993111E-16 1 0.1883682E-09 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 7 0 0.5517196E-08 1 0.3038605E-08 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 0.2033012E-15 1 0.8305770E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.8945484 average vibrational energy (ev) = 0.013406 average rotational energy (ev) = 0.481348 average diffraction energy (ev) = 0.055142 the reaction probability = 0.1054516D+00 etrans(icomin)= 0.151114 etrans(icomax)= 0.548327 etrans= 0.550000 CPU TIMES Total computation 294518.4878 (a) ... Propagating the wavefunction 291311.2942 (b) Setup time 2734.7464 Saving the wave function for rerun 125.4147 Calculating averages 8.7771 Calculating and saving BK-coeffs 44.7953 Asymptotic analysis 12.8159 Saving the flux coefficients 0.0000 Flux analysis 0.0000 ----------------------------------------------------- Sum 294237.8435 (a) ... FFTs along X and Y 11724.9797 Kinetic energy operation along Z 42999.7427 Kinetic energy operation along r 33513.1735 Potential energy multiplication 44717.5616 Legengre transforms 134890.5804 Shifting the wavefunction 11342.3929 Kinetic energy multiplications (xy) 1666.9524 Absorbing the wavefunction 2410.6635 Projection formalism 99.6507 Operations on specular grid 0.1758 ----------------------------------------------------- Sum 283365.8734 (b) ... Potential initialisation time 0.0001 Potential setup time 2642.9169 FFTs along X 7288.0416 FFTs along Y 4436.9380 Time spent on FGH for asympwf 0.5125 Ending date and time: Sat Aug 17 01:29:43 CEST 2019