 ../
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DarkSide/
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2325
(18 years ago)
by chrisfen:
slowdown fixed - now roughly the same speed as the old version when using dipoles
energies are now exactly the same between the old version of OOPSE and this version
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ForceField.cpp
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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ForceFieldCreator.hpp
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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EAM_FF.hpp
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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DUFF.hpp
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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ForceFieldFactory.cpp
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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EAM_FF.cpp
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2204
(19 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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ForceFieldFactory.hpp
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2211
(19 years ago)
by chrisfen:
Shapes is limping along with a array bounds overwrite (I think...). At least the parser loads the forcefield fine...
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SHAPES_FF.hpp
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2211
(19 years ago)
by chrisfen:
Shapes is limping along with a array bounds overwrite (I think...). At least the parser loads the forcefield fine...
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SHAPES_FF.cpp
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2211
(19 years ago)
by chrisfen:
Shapes is limping along with a array bounds overwrite (I think...). At least the parser loads the forcefield fine...
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Makefile
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2211
(19 years ago)
by chrisfen:
Shapes is limping along with a array bounds overwrite (I think...). At least the parser loads the forcefield fine...
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ForceField.hpp
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2211
(19 years ago)
by chrisfen:
Shapes is limping along with a array bounds overwrite (I think...). At least the parser loads the forcefield fine...
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DUFF.cpp
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2229
(19 years ago)
by chrisfen:
Modifications to tap. Also correcting changes to the previous merge that were not caught
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mpiComponentPlan.h
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2263
(18 years ago)
by tim:
replace c++ style comment in c files
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fSwitchingFunction.h
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2263
(18 years ago)
by tim:
replace c++ style comment in c files
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fCutoffPolicy.h
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2274
(18 years ago)
by gezelter:
added fCutoffPolicy.h
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notifyCutoffs_interface.F90
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2285
(18 years ago)
by gezelter:
adding c-side interface to change cutoff Policy
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notifyCutoffs_interface.h
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2285
(18 years ago)
by gezelter:
adding c-side interface to change cutoff Policy
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notifyCutoffs.F90
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2295
(18 years ago)
by chrisfen:
some changes to activate the coulombicCorrection selector
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doForces_interface.h
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2309
(18 years ago)
by chrisfen:
reaction field seems to work now, still need to do some testing...
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doForces_interface.F90
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2309
(18 years ago)
by chrisfen:
reaction field seems to work now, still need to do some testing...
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doForces.F90
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2323
(18 years ago)
by chuckv:
Fixed "dum-dum" where we ignore the skin thickness and hardcode listSkin to be 1.0. We now get listskin from skin. This will get fixed to where we can manually set skin thickness.
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