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.
thumbnail.jpeg28-Aug-2024SP_c60cn_nasaltGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-311+G(D,P)-2541.0977043; Eh
thumbnail.jpeg28-Aug-2024SP_c60cn_radicalGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureUM062X6-311+G(D,P)-2378.7113338; Eh
thumbnail.jpeg29-Jul-2024SP_F3-flatGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(D,P) SDD GENECP-1090.2834794; Eh
thumbnail.jpeg29-Jul-2024SP_F3disoGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(D,P) SDD GENECP-1090.3086736; Eh
thumbnail.jpeg29-Jul-2024SP_F4aGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(D,P) SDD GENECP-1090.3580136; Eh
thumbnail.jpeg29-Jul-2024SP_F4García-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(D,P) SDD GENECP-1090.3117426; Eh
thumbnail.jpeg29-Jul-2024SP_F5García-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(D,P) SDD GENECP-901.7601268; Eh
thumbnail.jpeg28-Aug-2024m062xD3LLTSP_c120_c_nrsGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X6-31+G(D,P)-4571.0282209; Eh
thumbnail.jpeg28-Aug-2024m06LLTSP_c120_c_nrsGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRM066-31+G(D,P)-4569.3082127; Eh
thumbnail.jpeg29-Jul-2024SP_E11-goldfulGarcía-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G(D,P) SDD GENECP-885.7458337; Eh
Results 931-940 of 100136 (Search time: 0.004 seconds).

Discover