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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	21-Jul-2020	Styrene_oxide	Jover Modrego, Jesús	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UB3LYP	DEF2SVP	-384.589922332; Eh
	21-Jul-2020	TAMOF	Jover Modrego, Jesús	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UB3LYP	DEF2SVP	-10000.0130099; Eh
	21-Jul-2020	RL1_product	Jover Modrego, Jesús	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	UB3LYP	DEF2SVP	-672.062139633; Eh
	21-Jul-2020	I-R	Jover Modrego, Jesús	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UB3LYP	DEF2SVP	-10384.6447492; Eh
	21-Jul-2020	I-S	Jover Modrego, Jesús	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UB3LYP	DEF2SVP	-10384.6434197; Eh
	21-Jul-2020	LL2_product	Jover Modrego, Jesús	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	UB3LYP	DEF2SVP	-1056.70133348; Eh
	21-Jul-2020	II-R	Jover Modrego, Jesús	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	DEF2SVP	-10672.0826961; Eh
	21-Jul-2020	LL1_product	Jover Modrego, Jesús	Gaussian; 09; ES64L-G09RevD.01	Geometry optimization Minimum	UB3LYP	DEF2SVP	-1056.70105418; Eh
	21-Jul-2020	Acetonitrile	Jover Modrego, Jesús	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UB3LYP	DEF2SVP	-132.665080875; Eh
	21-Jul-2020	Aniline	Jover Modrego, Jesús	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	UB3LYP	DEF2SVP	-287.421518073; Eh

Results 11-20 of 74 (Search time: 0.002 seconds).