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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg27-Jun-2018cluster-M06-L-4Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUM06LSDD; 6-31G**; 6-31+G*-3839.63421084; Eh
thumbnail.jpeg27-Jun-2018cluster-M06-L-2Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUM06LSDD; 6-31G**; 6-31+G*-3839.62044252; Eh
thumbnail.jpeg27-Jun-2018cluster-PBE-4Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUPBEPBESDD; 6-31G**; 6-31+G*-3836.29998559; Eh
thumbnail.jpeg27-Jun-2018cluster-PBE-2Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUPBEPBESDD; 6-31G**; 6-31+G*-3836.28872365; Eh
thumbnail.jpeg27-Jun-2018cluster-M06-L-6Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUM06LSDD; 6-31G**; 6-31+G*-3839.58221330; Eh
thumbnail.jpeg27-Jun-2018cluster-B3LYP-4Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPSDD; 6-31G**; 6-31+G*-3839.93524076; Eh
thumbnail.jpeg27-Jun-2018cluster-M06-L-2-spOrtuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureUM06LSDD; 6-31G**; 6-31+G*-3839.63400051; Eh
thumbnail.jpeg27-Jun-2018cluster-PBE-2-spOrtuño, ManuelGaussian; 09; EM64L-G09RevD.01Single point StructureUPBEPBESDD; 6-31G**; 6-31+G*-3836.29983166; Eh
thumbnail.jpeg27-Jun-2018cluster-B3LYP-2Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPSDD; 6-31G**; 6-31+G*-3839.91208792; Eh
Results 1-9 of 9 (Search time: 0.002 seconds).