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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 M5	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RwB97XD	GEN	-3959.21819834; Eh
	28-Feb-2021	/GeomOpt_wB97XD M4	Foscato, Marco	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-3959.1937626; 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 M73	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3925.46297641; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M70	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3925.47013663; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M61	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3925.46565228; Eh
	28-Feb-2021	/SP_PBEPBE_GD3MBJ_CHCl3 M53	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RPBEPBE	GENECP	-3925.47796957; Eh
	28-Feb-2021	/GeomOpt_wB97XD M73	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-3927.0026343; Eh
	28-Feb-2021	/GeomOpt_wB97XD M74	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-3927.0931922; Eh
	28-Feb-2021	/GeomOpt_wB97XD M62	Foscato, Marco	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RHF; RwB97XD	GENECP GEN	-3927.0638878; Eh

Results 401-410 of 630 (Search time: 0.002 seconds).