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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg8-Nov-2018/water/complexes aq-orhh2o5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-567.8486499; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-oticl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1514.6131218; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-pcl3cunh33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-2088.8045996; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-ohtame4piramBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-292.5590723; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-ohrhh2o5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-568.2660762; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-ohrush4Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1766.1735719; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-orush4Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1765.6587185; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-opdph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-546.5193356; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-opdhph32_nhcBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-890.1426602; Eh
thumbnail.jpeg8-Nov-2018/water/complexes aq-optf5singleteBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-694.2998623; Eh
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