1. Institute of Chemical Research of Catalonia

Search        

Start a new search
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required28-Aug-2024SP_obn_an_MePropGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(D,P)-385.6961906; Eh
Login required28-Aug-2024ar3no2obnGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D)-1566.94509823; Eh
Login required28-Aug-2024cnoac_radGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYP6-31G(D)-359.986113310; Eh
Login required28-Aug-2024SP_meohGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(D,P)-115.7716205; Eh
Login required28-Aug-2024ar2dmn2obn_meoh_MeButaGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D)-1271.23639342; Eh
Login required28-Aug-2024SP_ar2dmnome_radGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-311+G(D,P)-750.7053575; Eh
Login required28-Aug-2024ar2dmn2obn_PMMAGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D)-1155.49445441; Eh
Login required28-Aug-2024SP_mln_an_MeButaGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(D,P)-263.9017281; Eh
Login required28-Aug-2024SP_ar2dmnomemlnGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(D,P)-1014.5224769; Eh
Login required28-Aug-2024refdiarcn_radGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYP6-31G(D)-823.315318386; Eh
Results 90611-90620 of 91738 (Search time: 0.047 seconds).

Discover