| 4 |
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| 5 |
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!! @author Charles F. Vardeman II |
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!! @author Matthew Meineke |
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< |
!! @version $Id: do_Forces.F90,v 1.14 2003-04-10 16:22:00 mmeineke Exp $, $Date: 2003-04-10 16:22:00 $, $Name: not supported by cvs2svn $, $Revision: 1.14 $ |
| 7 |
> |
!! @version $Id: do_Forces.F90,v 1.15 2003-04-11 15:16:59 gezelter Exp $, $Date: 2003-04-11 15:16:59 $, $Name: not supported by cvs2svn $, $Revision: 1.15 $ |
| 8 |
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| 9 |
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module do_Forces |
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use force_globals |
| 487 |
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endif |
| 488 |
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| 489 |
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if (do_stress) then |
| 490 |
< |
call mpi_allreduce(tau_Temp, tau,9,mpi_double_precision,mpi_sum, & |
| 490 |
> |
call mpi_allreduce(tau_Temp, tau, 9,mpi_double_precision,mpi_sum, & |
| 491 |
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mpi_comm_world,mpi_err) |
| 492 |
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call mpi_allreduce(virial_Temp, virial,1,mpi_double_precision,mpi_sum, & |
| 493 |
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mpi_comm_world,mpi_err) |
| 525 |
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|
| 526 |
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r = sqrt(rijsq) |
| 527 |
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| 528 |
+ |
|
| 529 |
+ |
|
| 530 |
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#ifdef IS_MPI |
| 531 |
+ |
if (tagRow(i) .eq. tagColumn(j)) then |
| 532 |
+ |
write(0,*) 'do_pair is doing', i , j, tagRow(i), tagColumn(j) |
| 533 |
+ |
endif |
| 534 |
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|
| 535 |
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me_i = atid_row(i) |
| 536 |
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me_j = atid_col(j) |
