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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Sep-2022	/pF_Bpin/PhI/large_basis_sets Cu_Phen_pFPhPh_I	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-1627.8269054; Eh
	23-Sep-2022	/pCF3_Bpin/PhI Cu_Phen_pCF3PhPh_I	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GEN*	-1580.94112610; Eh
	23-Sep-2022	/pF_Bpin/PhI/large_basis_sets Cu_Phen_pFPh_PhI	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-1627.7256933; Eh
	23-Sep-2022	/pCF3_Bpin/PhI Cu_Phen_pCF3Ph_PhI	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GEN*	-1580.82985246; Eh
	23-Sep-2022	/pF_Bpin/PhI/large_basis_sets Cu_Phen_pFPh	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-1100.1842559; Eh
	23-Sep-2022	/mmMePh_Bpin Cu_Phen_mmMePhPh_I	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G SDD GEN*	-1322.54257186; Eh
	23-Sep-2022	/pF_Bpin/pNMe2_PhI pFPh-pNMe2Ph	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	6-31G GEN*	-696.532894316; Eh
	23-Sep-2022	/pF_Bpin/pNMe2_PhI OATS	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-31G SDD GEN*	-1476.96312315; Eh
	23-Sep-2022	/pCF3_Bpin/PhI OATS	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RB3LYP	6-31G SDD GEN*	-1580.79467811; Eh
	23-Sep-2022	/pCF3_Bpin/pNMe2_PhI/large_basis_sets Cu_Phen_pCF3PhpNMe2Ph_I	Jover Modrego, Jesús	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-311+G* GEN*	-1999.7322279; Eh

Results 24721-24730 of 100175 (Search time: 0.016 seconds).