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Comparing trunk/OOPSE-4/src/UseTheForce/DarkSide/simParallel.F90 (file contents):
Revision 1619 by chuckv, Wed Oct 20 21:16:01 2004 UTC vs.
Revision 1930 by gezelter, Wed Jan 12 22:41:40 2005 UTC

# Line 1 | Line 1
1 +
2 + !!
3 + !! Copyright (c) 2005 The University of Notre Dame. All Rights Reserved.
4 + !!
5 + !! The University of Notre Dame grants you ("Licensee") a
6 + !! non-exclusive, royalty free, license to use, modify and
7 + !! redistribute this software in source and binary code form, provided
8 + !! that the following conditions are met:
9 + !!
10 + !! 1. Acknowledgement of the program authors must be made in any
11 + !!    publication of scientific results based in part on use of the
12 + !!    program.  An acceptable form of acknowledgement is citation of
13 + !!    the article in which the program was described (Matthew
14 + !!    A. Meineke, Charles F. Vardeman II, Teng Lin, Christopher
15 + !!    J. Fennell and J. Daniel Gezelter, "OOPSE: An Object-Oriented
16 + !!    Parallel Simulation Engine for Molecular Dynamics,"
17 + !!    J. Comput. Chem. 26, pp. 252-271 (2005))
18 + !!
19 + !! 2. Redistributions of source code must retain the above copyright
20 + !!    notice, this list of conditions and the following disclaimer.
21 + !!
22 + !! 3. Redistributions in binary form must reproduce the above copyright
23 + !!    notice, this list of conditions and the following disclaimer in the
24 + !!    documentation and/or other materials provided with the
25 + !!    distribution.
26 + !!
27 + !! This software is provided "AS IS," without a warranty of any
28 + !! kind. All express or implied conditions, representations and
29 + !! warranties, including any implied warranty of merchantability,
30 + !! fitness for a particular purpose or non-infringement, are hereby
31 + !! excluded.  The University of Notre Dame and its licensors shall not
32 + !! be liable for any damages suffered by licensee as a result of
33 + !! using, modifying or distributing the software or its
34 + !! derivatives. In no event will the University of Notre Dame or its
35 + !! licensors be liable for any lost revenue, profit or data, or for
36 + !! direct, indirect, special, consequential, incidental or punitive
37 + !! damages, however caused and regardless of the theory of liability,
38 + !! arising out of the use of or inability to use software, even if the
39 + !! University of Notre Dame has been advised of the possibility of
40 + !! such damages.
41 + !!
42  
43  
44   !! MPI support for long range forces using force decomposition
# Line 7 | Line 48
48   !!
49   !! @author Charles F. Vardeman II
50   !! @author Matthew Meineke
51 < !! @version $Id: simParallel.F90,v 1.1 2004-10-20 21:16:01 chuckv Exp $, $Date: 2004-10-20 21:16:01 $, $Name: not supported by cvs2svn $, $Revision: 1.1 $
51 > !! @version $Id: simParallel.F90,v 1.2 2005-01-12 22:40:45 gezelter Exp $, $Date: 2005-01-12 22:40:45 $, $Name: not supported by cvs2svn $, $Revision: 1.2 $
52  
53   module mpiSimulation  
54    use definitions
# Line 816 | Line 857 | contains
857        
858         write(default_error,*) "nMolGlobal: ", mpiSim%nMolGlobal
859         write(default_error,*) "nAtomsGlobal: ", mpiSim%nAtomsGlobal
819       write(default_error,*) "nBondGlobal: ", mpiSim%nBondsGlobal
820       write(default_error,*) "nTorsionsGlobal: ", mpiSim%nTorsionsGlobal
821       write(default_error,*) "nSRIGlobal: ", mpiSim%nSRIGlobal
860         write(default_error,*) "nAtomsLocal: ", mpiSim%nAtomsLocal
861         write(default_error,*) "myNode: ", mpiSim%myNode
862         write(default_error,*) "nProcessors: ", mpiSim%nProcessors

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