 ../
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DarkSide/
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1883
(19 years ago)
by tim:
MPI version is built
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fSwitchingFunction.h
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1683
(19 years ago)
by :
This commit was manufactured by cvs2svn to create branch 'new_design'.
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notifyCutoffs.F90
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1683
(19 years ago)
by :
This commit was manufactured by cvs2svn to create branch 'new_design'.
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doForces_interface.h
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1683
(19 years ago)
by :
This commit was manufactured by cvs2svn to create branch 'new_design'.
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notifyCutoffs_interface.h
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1683
(19 years ago)
by :
This commit was manufactured by cvs2svn to create branch 'new_design'.
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mpiComponentPlan.h
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1722
(19 years ago)
by tim:
adding ForceManager
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ForceField.hpp
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1807
(19 years ago)
by tim:
brains get built
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Shapes_FF.cpp
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1829
(19 years ago)
by tim:
minor fix
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ForceField.cpp
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1847
(19 years ago)
by tim:
NVE conserved energy, however, potential is not the same as OOPSE-1.0
Step 1 argon in NVE, NVT, NPTi, NPTf and NPTxyz to test integrator
Step 2 SSD in NVE to test DLM, dipole, sticky
Step 3 Butane in NVE to test Bond Bend Torsion
Step 4 EAM
Step 5 Shape
Step 6 Constraint & Restraint
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doForces.F90
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1877
(19 years ago)
by tim:
sticky module get compiled
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DUFF.cpp
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1890
(19 years ago)
by tim:
add EAM Force Field
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DUFF.hpp
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1890
(19 years ago)
by tim:
add EAM Force Field
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EAM.cpp
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1892
(19 years ago)
by tim:
add getMaxRcutFromAtomType into EAM
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EAM.hpp
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1892
(19 years ago)
by tim:
add getMaxRcutFromAtomType into EAM
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ForceFieldCreator.hpp
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1913
(19 years ago)
by tim:
create a register module to register force fields, integrators and minimizers
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ForceFieldFactory.cpp
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1913
(19 years ago)
by tim:
create a register module to register force fields, integrators and minimizers
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Makefile
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1913
(19 years ago)
by tim:
create a register module to register force fields, integrators and minimizers
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ForceFieldFactory.hpp
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1913
(19 years ago)
by tim:
create a register module to register force fields, integrators and minimizers
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