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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2okBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-104.7110609; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2ofecl2sextupBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1120.6891452; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2onbnh24Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-357.2463884; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2mno3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-330.8374979; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2oticl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1515.4057994; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2orush4Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1766.6343204; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2ocro3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-389.1588636; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2ooso3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-392.285877; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2oconh35Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-504.7724076; Eh
thumbnail.jpeg9-Nov-2018/water//water complexes aq-h2fecl2sextupBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1045.394891; Eh
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