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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg10-Mar-2021/SUBSTRACT Pd-PPh3Maza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XDLANL2DZ 6-31G(D,P) GENECP-1544.10831674; Eh
thumbnail.jpeg10-Mar-2021/SUBSTRACT Cu-PPh3Maza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XDLANL2DZ 6-31G(D,P) GENECP-1598.54805816; Eh
thumbnail.jpeg10-Mar-2021/SUBSTRACT BromoethaneMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XDLANL2DZ 6-31G(D,P) GENECP-92.3950565867; Eh
thumbnail.jpeg10-Mar-2021/ANIONIC 1aNpinMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XD6-31G(D,P)-410.672679023; Eh
thumbnail.jpeg10-Mar-2021/SUBSTRACT Cp-HMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XD6-31G(D,P)-194.042296726; Eh
thumbnail.jpeg10-Mar-2021/SUBSTRACT CpMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XD6-31G(D,P)-193.441375390; Eh
thumbnail.jpeg10-Mar-2021/ANIONIC 1amesMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XD6-31G(D,P)-763.161976370; Eh
thumbnail.jpeg10-Mar-2021/ANIONIC/TS 1bpin-aductMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XDLANL2DZ 6-31G(D,P) GENECP-582.159735595; Eh
thumbnail.jpeg10-Mar-2021/NEUTRAL 2a2dan-HMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XD6-31G(D,P)-1079.70545588; Eh
thumbnail.jpeg10-Mar-2021/ANIONIC/TS 1ames-aductMaza Quiroga, Ricardo JoséGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XDLANL2DZ 6-31G(D,P) GENECP-855.586037349; Eh
Results 11-20 of 65 (Search time: 0.001 seconds).