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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg7-Jul-2020MECP1t_bBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31G* SDD GENECP-10019.8226648; Eh
thumbnail.jpeg7-Jul-2020HMECP1asBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31G* SDD GENECP-9867.38949994; Eh
thumbnail.jpeg7-Jul-2020MECP1sBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31G* SDD GENECP-10019.8806809; Eh
thumbnail.jpeg7-Jul-2020HMECP0ctBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31G* SDD GENECP-9867.35825168; Eh
thumbnail.jpeg7-Jul-2020HMECP0btBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31G* SDD GENECP-9867.36559175; Eh
thumbnail.jpeg7-Jul-2020HMECP1csBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31G* SDD GENECP-9867.43467390; Eh
thumbnail.jpeg7-Jul-2020HMECP0csBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31G* SDD GENECP-9867.35824714; Eh
thumbnail.jpeg7-Jul-2020MECP1s_bBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31G* SDD GENECP-10019.8226680; Eh
thumbnail.jpeg7-Jul-2020HMECP1btBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31G* SDD GENECP-9867.39076113; Eh
thumbnail.jpeg7-Jul-2020MECP2sBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31G* SDD GENECP-10894.2102318; Eh
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