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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	28-Feb-2021	/GeomOpt_wB97XD M58	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	GEN	-3927.12285660; Eh
	28-Feb-2021	/GeomOpt_wB97XD M21	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RwB97XD	GENECP GEN	-3880.66169553; Eh
	28-Feb-2021	/GeomOpt_wB97XD M14	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-3959.2493957; Eh
	28-Feb-2021	/GeomOpt_wB97XD M16	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-3959.279929; Eh
	28-Feb-2021	/GeomOpt_wB97XD M15	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-3959.235414; Eh
	28-Feb-2021	/GeomOpt_wB97XD M10	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-3959.2264985; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M22_singlet	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3957.60336914; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M22_triplet	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	UPBEPBE	GENECP	-3957.59730616; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M73	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3925.46297641; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M60	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3925.47028195; Eh

Results 411-420 of 462 (Search time: 0.001 seconds).