log.none-cosine-squared
778d32327db2efficient_neuronet

log.none-cosine-squared
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			Step Temp E_pair E_mol TotEng Press
			0 0 0 8.1251699 8.1251699 0.000000
			1 148.48751 0 5.7255308 7.9385961 101.164253
			--
			Step Temp E_pair E_mol TotEng Press
			0 148.48751 0 5.7255308 7.9385961 101.164253
			1 419.55539 0 1.3180334 7.571108 285.842275
			--
			Step Temp E_pair E_mol TotEng Press
			1 148.48751 0 5.7255308 7.9385961 101.164253
			2 419.55539 0 1.3180334 7.571108 285.842275