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lammps/regtest/bond/ref/log.harmonic-shift-none
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log.harmonic-shift-none
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Step Temp E_pair E_mol TotEng Press
0 0 0 -399.98185 -399.98185 82.670827
1 0.046543578 0 -399.98255 -399.98185 81.107729
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Step Temp E_pair E_mol TotEng Press
0 0.046543578 0 -180.16414 -180.16344 36.550781
1 0.095879348 0 -180.16488 -180.16345 34.843250
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Step Temp E_pair E_mol TotEng Press
1 0.046543578 0 -399.98255 -399.98185 81.107729
2 0.17899078 0 -399.98454 -399.98187 76.471982
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