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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/vacuum/complexes fenilomepdph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-817.319863775; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2fecl2sextupBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSUB3LYP6-31+g*; sdd-1045.24323401; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ph3ircoph32Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1247.0395606; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes fenilomeauph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-825.141273131; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ph3auph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-821.8955353; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes fenilomewco5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-980.173423905; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-oticl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1514.5319432; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes fenilomeoso3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-662.277477110; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes fenilomekBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-374.471189178; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes fenilomeircoph32Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1250.29627579; Eh
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