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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Aug-2018SP_MECP_III_tripletBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUBP866-31g(d); sdd-1038.07588453; Eh
thumbnail.jpeg30-Aug-2018VI3Besora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUBP866-31g(d); sdd-1190.97000581; Eh
thumbnail.jpeg30-Aug-2018SP_MECP_VIII_tripletBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUBP866-31g(d); sdd-1386.11441752; Eh
thumbnail.jpeg30-Aug-2018III_tripletBesora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUBP866-31g(d); sdd-1038.09183999; Eh
thumbnail.jpeg30-Aug-2018VBesora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUBP866-31g(d); sdd-1114.53305168; Eh
thumbnail.jpeg30-Aug-2018VIII_tripletBesora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUBP866-31g(d); sdd-1386.11791525; Eh
thumbnail.jpeg30-Aug-2018VI5Besora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUBP866-31g(d); sdd-1114.53717283; Eh
thumbnail.jpeg30-Aug-2018O2Besora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUBP866-31g(d)-150.327271826; Eh
thumbnail.jpeg30-Aug-2018TS_VIBesora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSUBP866-31g(d); sdd-1190.95957074; Eh
thumbnail.jpeg30-Aug-2018TS_VIIBesora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSUBP866-31g(d); sdd-1386.09725987; Eh
Results 1-10 of 17 (Search time: 0.001 seconds).