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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/vacuum/complexes nme3aucnBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-403.166464061; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes nh2cuch3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-293.271062691; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes nh2zncl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-1663.88750267; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes imidazolcrh2o5tripBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-694.945258213; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes hecrh2o5tripBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-471.515650046; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes imidazolagnhcBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-599.322615562; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes hefecl3baiBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1507.55404544; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes heniph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-516.969888954; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes oauph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-554.155985638; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes heincl2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-924.965883654; Eh
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