log.none-cosine
756c87c7d907efficient_neuronet

log.none-cosine
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			Step Temp E_pair E_mol TotEng Press
			0 0 0 13.333352 13.333352 0.000000
			1 5.3608758 0 13.253402 13.3333 3.652354
			--
			Step Temp E_pair E_mol TotEng Press
			0 5.3608758 0 13.253402 13.3333 3.652354
			1 21.387062 0 13.014383 13.333137 14.570964
			--
			Step Temp E_pair E_mol TotEng Press
			1 5.3608758 0 13.253402 13.3333 3.652354
			2 21.387062 0 13.014383 13.333137 14.570964