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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg8-Nov-2018/water/complexes aq-hticl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1439.7198762; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-ikBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPsdd-39.8881958; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-ifecl3-Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1516.5083048; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-hwco5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-634.6438874; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-hetame4piramBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-219.4203982; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-hrhh2o5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-493.0420189; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-hptf5singleteBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-619.6016589; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-heticl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1441.8329035; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-icro3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-324.3598477; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-heZrCl5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-2351.5067782; Eh
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