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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M15	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3957.59618739; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M21	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3879.06283534; Eh
	17-Mar-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M80	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-2058.52225682; Eh
	17-Mar-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M84	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-2058.52461427; Eh
	17-Mar-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M87	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-1921.46409141; Eh
	17-Mar-2021	/GeomOpt_wB97XD M75	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	GEN	-2251.09213378; Eh
	17-Mar-2021	/GeomOpt_wB97XD M82	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-1811.1435334; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M1	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-2226.90698285; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M2	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-1978.77534849; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M5	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3957.61205015; Eh

Results 51-60 of 630 (Search time: 0.001 seconds).