ioChem-BD Browse - Barcelona Supercomputing Center: Search

Search

previous
1
...
242
243
244
245
246
247
248
...
250
next

Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	25-Jan-2024	aimel_066144	Cortes Guzman, Fernando	Gaussian; 16; EM64L-G16RevA.03	Single point Structure	RB3LYP	6-31G(2DF,P)	-404.4876585; Eh
	25-Jan-2024	aimel_066152	Cortes Guzman, Fernando	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31G(2DF,P)	-388.460603; Eh
	25-Jan-2024	aimel_066148	Cortes Guzman, Fernando	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31G(2DF,P)	-388.4653678; Eh
	25-Jan-2024	aimel_066168	Cortes Guzman, Fernando	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31G(2DF,P)	-440.4361774; Eh
	25-Jan-2024	aimel_066162	Cortes Guzman, Fernando	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31G(2DF,P)	-424.3958671; Eh
	25-Jan-2024	aimel_066159	Cortes Guzman, Fernando	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31G(2DF,P)	-424.397786; Eh
	25-Jan-2024	aimel_066165	Cortes Guzman, Fernando	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31G(2DF,P)	-440.459495; Eh
	25-Jan-2024	aimel_066174	Cortes Guzman, Fernando	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31G(2DF,P)	-460.301181; Eh
	25-Jan-2024	aimel_066183	Cortes Guzman, Fernando	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31G(2DF,P)	-367.3886291; Eh
	25-Jan-2024	aimel_066160	Cortes Guzman, Fernando	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	6-31G(2DF,P)	-388.5012833; Eh

Results 2441-2450 of 2492 (Search time: 0.003 seconds).