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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 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
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M3	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3957.58618294; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M23	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	UPBEPBE	GENECP	-3957.62506866; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M34	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	UPBEPBE	GENECP	-3879.05052058; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M42	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3925.46486594; Eh
	17-Mar-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M80	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-2058.52225682; Eh

Results 31-40 of 462 (Search time: 0.0 seconds).