Search        

Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/vacuum/complexes sih3-crh2o5tripBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-760.257717780; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ch3-fecl2sextupBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1084.29804; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ch3-ptf5singleteBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-658.5896273; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-brircoph32Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-917.5347483; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-ch3-ticl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1479.0427432; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-brZrCl5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-2361.9124407; Eh
thumbnail.jpeg9-Nov-2018/noDisp/complexes sin-clalcl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*-2083.6129326; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes sih3-cuch3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-528.623210434; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes pme3nipf33Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-2555.15154006; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes pme3agnhcBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-834.207659417; Eh
Results 4921-4930 of 12842 (Search time: 0.005 seconds).