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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg26-Apr-2017ts_7a-8aKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D--1234.66895672; Eh
thumbnail.jpeg26-Apr-20174solvent-csKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31+g(d); LANL2DZ-1013.45147994; Eh
thumbnail.jpeg26-Apr-2017ts_2b-3´bKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D6-31+g(d); LANL2DZ-1971.94892191; Eh
thumbnail.jpeg26-Apr-2017ts_7b-8bKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D6-31+g(d); LANL2DZ-2268.15969311; Eh
thumbnail.jpeg26-Apr-2017ts_3b-4bKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D6-31+g(d); LANL2DZ-1462.91078359; Eh
thumbnail.jpeg26-Apr-20172bKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31+g(d); LANL2DZ-1971.97027671; Eh
thumbnail.jpeg26-Apr-20174bKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31+g(d); LANL2DZ-1462.92720857; Eh
thumbnail.jpeg26-Apr-2017ts_2a-3´aKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D6-31+g(d)-1455.21636131; Eh
thumbnail.jpeg26-Apr-20177aKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31+g(d)-1234.68129499; Eh
thumbnail.jpeg26-Apr-20175aKuniyil, RosithaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D6-31+g(d)-1134.67902534; Eh
Results 21-30 of 163 (Search time: 0.001 seconds).