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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-nhcoso3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-541.8451187; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes fenilno2auph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-915.128528496; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-nh3wco5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-690.4790275; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-nh3fecl2sextupBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1100.7050635; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-nh3ircoph32Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-960.4621834; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ncstame4piramBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-707.7493947; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ncsrhh2o5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-983.1781029; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-nh3rhh2o5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-548.1768891; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-nh3conh35Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-484.2558691; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ncsznch3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-758.1361143; Eh
Results 5281-5290 of 12842 (Search time: 0.005 seconds).