Search        

Current filters:
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg26-Dec-2022/other_bases/TEA TEA-proR-3_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2804.8380245; Eh
thumbnail.jpeg26-Dec-2022/Redox H2O+_s2_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-76.1095304; Eh
thumbnail.jpeg26-Dec-2022/Redox LCu2AHFIP_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2708.9265064; Eh
thumbnail.jpeg26-Dec-2022/Redox LCu2HFIP2_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2849.2147619; Eh
thumbnail.jpeg26-Dec-2022/Redox A_s2_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-649.1415457; Eh
thumbnail.jpeg26-Dec-2022/mechanism_and_profile/I0Nu I0Nu-1_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2700.4894914; Eh
thumbnail.jpeg26-Dec-2022/mechanism_and_profile/TS4 TS4s_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2883.5023161; Eh
thumbnail.jpeg26-Dec-2022/mechanism_and_profile/I6 I6_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2291.0949666; Eh
thumbnail.jpeg26-Dec-2022/mechanism_and_profile/I5 I5_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2291.1033512; Eh
thumbnail.jpeg26-Dec-2022/other_bases/TEA TEA-proR-4_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ AUG-CC-PVTZ GENECP-2804.8376536; Eh
Results 181-190 of 210 (Search time: 0.002 seconds).