lj.res

Fortran科学计算程序,计算原子间力的大小,能级分布

    14.18983411970384       7.094917059851918    
         2000
   0.2673000164151194    
   0.0000000000000000E+00  0.0000000000000000E+00  0.0000000000000000E+00
   0.0000000000000000E+00  0.0000000000000000E+00   1.091525701515680    
   0.0000000000000000E+00  0.0000000000000000E+00   2.183051403031359    
   0.0000000000000000E+00  0.0000000000000000E+00   3.274577104547039    
   0.0000000000000000E+00  0.0000000000000000E+00   4.366102806062718    
   0.0000000000000000E+00  0.0000000000000000E+00   5.457628507578399    
   0.0000000000000000E+00  0.0000000000000000E+00   6.549154209094079    
   0.0000000000000000E+00  0.0000000000000000E+00   7.640679910609759    
   0.0000000000000000E+00  0.0000000000000000E+00   8.732205612125439    
   0.0000000000000000E+00  0.0000000000000000E+00   9.823731313641119    
   0.0000000000000000E+00  0.0000000000000000E+00   10.91525701515680    
   0.0000000000000000E+00  0.0000000000000000E+00   12.00678271667248    
   0.0000000000000000E+00  0.0000000000000000E+00   13.09830841818816    
   0.0000000000000000E+00   1.091525701515680      0.0000000000000000E+00
   0.0000000000000000E+00   1.091525701515680       1.091525701515680    
   0.0000000000000000E+00   1.091525701515680       2.183051403031359    
   0.0000000000000000E+00   1.091525701515680       3.274577104547039    
   0.0000000000000000E+00   1.091525701515680       4.366102806062718    
   0.0000000000000000E+00   1.091525701515680       5.457628507578399    
   0.0000000000000000E+00   1.091525701515680       6.549154209094079    
   0.0000000000000000E+00   1.091525701515680       7.640679910609759    
   0.0000000000000000E+00   1.091525701515680       8.732205612125439    
   0.0000000000000000E+00   1.091525701515680       9.823731313641119    
   0.0000000000000000E+00   1.091525701515680       10.91525701515680    
   0.0000000000000000E+00   1.091525701515680       12.00678271667248    
   0.0000000000000000E+00   1.091525701515680       13.09830841818816    
   0.0000000000000000E+00   2.183051403031359      0.0000000000000000E+00
   0.0000000000000000E+00   2.183051403031359       1.091525701515680    
   0.0000000000000000E+00   2.183051403031359       2.183051403031359    
   0.0000000000000000E+00   2.183051403031359       3.274577104547039    
   0.0000000000000000E+00   2.183051403031359       4.366102806062718    
   0.0000000000000000E+00   2.183051403031359       5.457628507578399    
   0.0000000000000000E+00   2.183051403031359       6.549154209094079    
   0.0000000000000000E+00   2.183051403031359       7.640679910609759    
   0.0000000000000000E+00   2.183051403031359       8.732205612125439    
   0.0000000000000000E+00   2.183051403031359       9.823731313641119    
   0.0000000000000000E+00   2.183051403031359       10.91525701515680    
   0.0000000000000000E+00   2.183051403031359       12.00678271667248    
   0.0000000000000000E+00   2.183051403031359       13.09830841818816    
   0.0000000000000000E+00   3.274577104547039      0.0000000000000000E+00
   0.0000000000000000E+00   3.274577104547039       1.091525701515680    
   0.0000000000000000E+00   3.274577104547039       2.183051403031359    
   0.0000000000000000E+00   3.274577104547039       3.274577104547039    
   0.0000000000000000E+00   3.274577104547039       4.366102806062718    
   0.0000000000000000E+00   3.274577104547039       5.457628507578399    
   0.0000000000000000E+00   3.274577104547039       6.549154209094079    
   0.0000000000000000E+00   3.274577104547039       7.640679910609759    
   0.0000000000000000E+00   3.274577104547039       8.732205612125439    
   0.0000000000000000E+00   3.274577104547039       9.823731313641119    
   0.0000000000000000E+00   3.274577104547039       10.91525701515680    
   0.0000000000000000E+00   3.274577104547039       12.00678271667248    
   0.0000000000000000E+00   3.274577104547039       13.09830841818816    
   0.0000000000000000E+00   4.366102806062718      0.0000000000000000E+00
   0.0000000000000000E+00   4.366102806062718       1.091525701515680    
   0.0000000000000000E+00   4.366102806062718       2.183051403031359    
   0.0000000000000000E+00   4.366102806062718       3.274577104547039    
   0.0000000000000000E+00   4.366102806062718       4.366102806062718    
   0.0000000000000000E+00   4.366102806062718       5.457628507578399    
   0.0000000000000000E+00   4.366102806062718       6.549154209094079    
   0.0000000000000000E+00   4.366102806062718       7.640679910609759    
   0.0000000000000000E+00   4.366102806062718       8.732205612125439    
   0.0000000000000000E+00   4.366102806062718       9.823731313641119    
   0.0000000000000000E+00   4.366102806062718       10.91525701515680    
   0.0000000000000000E+00   4.366102806062718       12.00678271667248    
   0.0000000000000000E+00   4.366102806062718       13.09830841818816    
   0.0000000000000000E+00   5.457628507578399      0.0000000000000000E+00
   4.2311071265932122E-02   5.487351227371123       1.055946412249858    
   0.0000000000000000E+00   5.457628507578399       2.183051403031359    
   0.0000000000000000E+00   5.457628507578399       3.274577104547039    
   0.0000000000000000E+00   5.457628507578399       4.366102806062718    
   0.0000000000000000E+00   5.457628507578399       5.457628507578399    
   0.0000000000000000E+00   5.457628507578399       6.549154209094079    
   0.0000000000000000E+00   5.457628507578399       7.640679910609759    
   0.0000000000000000E+00   5.457628507578399       8.732205612125439    
   0.0000000000000000E+00   5.457628507578399       9.823731313641119    
   0.0000000000000000E+00   5.457628507578399       10.91525701515680    
    14.14826269713460       5.461847708586767       12.04720674244188    
   0.0000000000000000E+00   5.457628507578399       13.09830841818816    
   0.0000000000000000E+00   6.549154209094079      0.0000000000000000E+00
   0.0000000000000000E+00   6.549154209094079       1.091525701515680    
   0.0000000000000000E+00   6.549154209094079       2.183051403031359    
   0.0000000000000000E+00   6.549154209094079       3.274577104547039    
   0.0000000000000000E+00   6.549154209094079       4.366102806062718    
   0.0000000000000000E+00   6.549154209094079       5.457628507578399    
   0.0000000000000000E+00   6.549154209094079       6.549154209094079    
   0.0000000000000000E+00   6.549154209094079       7.640679910609759    
   0.0000000000000000E+00   6.549154209094079       8.732205612125439    
   0.0000000000000000E+00   6.549154209094079       9.823731313641119    
   0.0000000000000000E+00   6.549154209094079       10.91525701515680    
   0.0000000000000000E+00   6.549154209094079       12.00678271667248    
   0.0000000000000000E+00   6.549154209094079       13.09830841818816    
   0.0000000000000000E+00   7.640679910609759      0.0000000000000000E+00
   0.0000000000000000E+00   7.640679910609759       1.091525701515680    
   0.0000000000000000E+00   7.640679910609759       2.183051403031359    
   0.0000000000000000E+00   7.640679910609759       3.274577104547039    
   0.0000000000000000E+00   7.640679910609759       4.366102806062718    
   0.0000000000000000E+00   7.640679910609759       5.457628507578399    
   0.0000000000000000E+00   7.640679910609759       6.549154209094079    
   0.0000000000000000E+00   7.640679910609759       7.640679910609759    
   0.0000000000000000E+00   7.640679910609759       8.732205612125439    
   0.0000000000000000E+00   7.640679910609759       9.823731313641119    
   0.0000000000000000E+00   7.640679910609759       10.91525701515680    
   0.0000000000000000E+00   7.640679910609759       12.00678271667248    
   0.0000000000000000E+00   7.640679910609759       13.09830841818816    
   0.0000000000000000E+00   8.732205612125439      0.0000000000000000E+00
   0.0000000000000000E+00   8.732205612125439       1.091525701515680    
   0.0000000000000000E+00   8.732205612125439       2.183051403031359    
   0.0000000000000000E+00   8.732205612125439       3.274577104547039    
   0.0000000000000000E+00   8.732205612125439       4.366102806062718    
   0.0000000000000000E+00   8.732205612125439       5.457628507578399    
   0.0000000000000000E+00   8.732205612125439       6.549154209094079    
   0.0000000000000000E+00   8.732205612125439       7.640679910609759    
   0.0000000000000000E+00   8.732205612125439       8.732205612125439    
   0.0000000000000000E+00   8.732205612125439       9.823731313641119    
   0.0000000000000000E+00   8.732205612125439       10.91525701515680    
   6.5786076822820949E-02   8.783578918188637       12.02448282609401    
   0.0000000000000000E+00   8.732205612125439       13.09830841818816    
   0.0000000000000000E+00   9.823731313641119      0.0000000000000000E+00
   0.0000000000000000E+00   9.823731313641119       1.091525701515680    
   0.1216430283793203       9.844383924366564       2.293152093156453    
   0.0000000000000000E+00   9.823731313641119       3.274577104547039    
   0.0000000000000000E+00   9.823731313641119       4.366102806062718    
   0.0000000000000000E+00   9.823731313641119       5.457628507578399    
   0.0000000000000000E+00   9.823731313641119       6.549154209094079    
   0.0000000000000000E+00   9.823731313641119       7.640679910609759    
   0.0000000000000000E+00   9.823731313641119       8.732205612125439    
   0.0000000000000000E+00   9.823731313641119       9.823731313641119    
   0.0000000000000000E+00   9.823731313641119       10.91525701515680    
   0.0000000000000000E+00   9.823731313641119       12.00678271667248    
   2.7470787856975307E-02   9.832401062871323       13.06256115444656    
   0.0000000000000000E+00   10.91525701515680      0.0000000000000000E+00
   0.0000000000000000E+00   10.91525701515680       1.091525701515680    
   0.0000000000000000E+00   10.91525701515680       2.183051403031359    
   0.0000000000000000E+00   10.91525701515680       3.274577104547039    
   0.0000000000000000E+00   10.91525701515680       4.366102806062718    
   0.0000000000000000E+00   10.91525701515680       5.457628507578399    
   0.0000000000000000E+00   10.91525701515680       6.549154209094079    
   0.0000000000000000E+00   10.91525701515680       7.640679910609759    
   0.0000000000000000E+00   10.91525701515680       8.732205612125439    
   0.0000000000000000E+00   10.91525701515680       9.823731313641119    
   0.0000000000000000E+00   10.91525701515680       10.91525701515680    
   0.0000000000000000E+00   10.91525701515680       12.00678271667248    
   0.0000000000000000E+00   10.91525701515680       13.09830841818816    
   0.0000000000000000E+00   12.00678271667248      0.0000000000000000E+00
   0.0000000000000000E+00   12.00678271667248       1.091525701515680    
   0.0000000000000000E+00   12.00678271667248       2.183051403031359    
   0.0000000000000000E+00   12.00678271667248       3.274577104547039    
   0.0000000000000000E+00   12.00678271667248       4.366102806062718    
   0.0000000000000000E+00   12.00678271667248       5.457628507578399    
   0.0000000000000000E+00   12.00678271667248       6.549154209094079    
   0.0000000000000000E+00   12.00678271667248       7.640679910609759    
   4.4930427998188499E-02   11.96806160597152       8.715078935136219    
   0.0000000000000000E+00   12.00678271667248       9.823731313641119    
   0.0000000000000000E+00   12.00678271667248       10.91525701515680    
   1.2351304939746809E-02   11.95780291987712       12.00241524886236    
   0.0000000000000000E+00   12.00678271667248       13.09830841818816    
   0.0000000000000000E+00   13.09830841818816      0.0000000000000000E+00
   0.0000000000000000E+00   13.09830841818816       1.091525701515680    
   0.0000000000000000E+00   13.09830841818816       2.183051403031359    
   0.0000000000000000E+00   13.09830841818816       3.274577104547039    
   0.0000000000000000E+00   13.09830841818816       4.366102806062718    
   0.0000000000000000E+00   13.09830841818816       5.457628507578399    
   0.0000000000000000E+00   13.09830841818816       6.549154209094079    
   0.0000000000000000E+00   13.09830841818816       7.640679910609759    
   0.0000000000000000E+00   13.09830841818816       8.732205612125439    
   0.0000000000000000E+00   13.09830841818816       9.823731313641119    
   0.0000000000000000E+00   13.09830841818816       10.91525701515680    
   0.0000000000000000E+00   13.09830841818816       12.00678271667248    
   0.0000000000000000E+00   13.09830841818816       13.09830841818816    
    1.091525701515680      0.0000000000000000E+00  0.0000000000000000E+00
    1.091525701515680      0.0000000000000000E+00   1.091525701515680    
    1.091525701515680      0.0000000000000000E+00   2.183051403031359    
    1.091525701515680      0.0000000000000000E+00   3.274577104547039    
    1.091525701515680      0.0000000000000000E+00   4.366102806062718    
    1.091525701515680      0.0000000000000000E+00   5.457628507578399