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!! @author Matthew Meineke |
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!! @author Christopher Fennel |
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!! @author J. Daniel Gezelter |
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< |
!! @version $Id: calc_sticky_pair.F90,v 1.5 2003-04-07 20:06:26 mmeineke Exp $, $Date: 2003-04-07 20:06:26 $, $Name: not supported by cvs2svn $, $Revision: 1.5 $ |
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!! @version $Id: calc_sticky_pair.F90,v 1.6 2003-04-07 21:20:38 mmeineke Exp $, $Date: 2003-04-07 21:20:38 $, $Name: not supported by cvs2svn $, $Revision: 1.6 $ |
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module sticky_pair |
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f_Col(2,atom2) = f_Col(2,atom2) - fyradial |
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f_Col(3,atom2) = f_Col(3,atom2) - fzradial |
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#else |
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< |
f(1,atom1) = f(1,atom1) + fxradial |
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< |
f(2,atom1) = f(2,atom1) + fyradial |
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f(3,atom1) = f(3,atom1) + fzradial |
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> |
f(1,atom1) = f(1,atom1) - fxradial |
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f(2,atom1) = f(2,atom1) - fyradial |
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f(3,atom1) = f(3,atom1) - fzradial |
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< |
f(1,atom2) = f(1,atom2) - fxradial |
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f(2,atom2) = f(2,atom2) - fyradial |
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f(3,atom2) = f(3,atom2) - fzradial |
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f(1,atom2) = f(1,atom2) + fxradial |
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f(2,atom2) = f(2,atom2) + fyradial |
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f(3,atom2) = f(3,atom2) + fzradial |
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#endif |
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if (do_stress) then |