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lammps/regtest/bond/ref/log.none-charmm-a
778d32327db2lammm-master-deprecated

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log.none-charmm-a
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Step Temp E_pair E_mol TotEng Press
0 0 0 20.786113 20.786113 0.000000
1 228.5939 0 17.215876 20.622851 155.740582
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Step Temp E_pair E_mol TotEng Press
0 228.5939 0 17.215876 20.622851 155.740582
1 755.44844 0 8.9924615 20.251703 514.685564
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Step Temp E_pair E_mol TotEng Press
1 228.5939 0 17.215876 20.622851 155.740582
2 755.44844 0 8.9924615 20.251703 514.685564
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