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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	17-Mar-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M88	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-1921.45982688; Eh
	17-Mar-2021	/GeomOpt_wB97XD M87	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	GEN	-1922.25408449; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M8	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3957.59412747; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M14	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3957.61088103; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M37	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-2210.84445189; Eh
	17-Mar-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M78	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-2001.98512090; Eh
	17-Mar-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M83	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-2058.52764434; Eh
	17-Mar-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M85	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-1810.40487234; Eh
	17-Mar-2021	/GeomOpt_wB97XD M77	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-2002.8302739; Eh
	17-Mar-2021	/GeomOpt_wB97XD M90	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-1673.9787324; Eh

Results 31-40 of 462 (Search time: 0.002 seconds).