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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/vacuum/complexes cnmosh3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-1357.50079923; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes ch3-mno3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-369.873722206; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes clZrCl5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-2808.73833170; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes clcro3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-773.057366756; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes closo3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-776.221886621; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes ch3-rush4Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-1730.17121754; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes ch3-mosh3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-1304.56985913; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes brwco5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-647.442101117; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes brrhh2o5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-505.554029480; Eh
thumbnail.jpeg9-Nov-2018/vacuum/metal_frag ircoph32b3lypBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-903.837591992; Eh
Results 621-630 of 683 (Search time: 0.002 seconds).