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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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1491 (19 years ago) by : This commit was manufactured by cvs2svn to create tag 'OOPSE_REWRITE'. |
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1845 (19 years ago) by chrisfen: the short version |