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r1852
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UseTheForce/ 1851 (19 years ago) by tim: NVE is working now, get the same result as OOPSE-1.0
applications/ 1852 (19 years ago) by tim: add Integrator.cpp
brains/ 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
constraints/ 1832 (19 years ago) by tim: still have two linking problem
integrators/ 1852 (19 years ago) by tim: add Integrator.cpp
io/ 1846 (19 years ago) by tim: Dump2Xyz is also working, energy of NVE is not conserved
math/ 1851 (19 years ago) by tim: NVE is working now, get the same result as OOPSE-1.0
minimizers/ 1830 (19 years ago) by tim: change endl to std::endl
primitives/ 1850 (19 years ago) by tim: rewind to old copy
profiling/ 1683 (19 years ago) by : This commit was manufactured by cvs2svn to create branch 'new_design'.
restraints/ 1830 (19 years ago) by tim: change endl to std::endl
types/ 1837 (19 years ago) by tim: refine factory pattern to make it initialized correctly
utils/ 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
visitors/ 1832 (19 years ago) by tim: still have two linking problem
Makefile 1683 (19 years ago) by : This commit was manufactured by cvs2svn to create branch 'new_design'.
config.h.in 1683 (19 years ago) by : This commit was manufactured by cvs2svn to create branch 'new_design'.
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