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
NVE get built
rename DumpWrite to DumpWriter
add SetForceManager method to integrator
refactory NPT integrator
adding ForceManager
More to break
This commit was manufactured by cvs2svn to create branch 'new_design'.
change the #include in source files
Import of OOPSE v. 2.0
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