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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Nov-2018/vacuum/complexes hemno3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-332.425995206; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes hekBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-31.0589441082; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes hecro3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-315.558996738; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2sznch3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-666.200598147; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2swco5Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-1033.30820331; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2sticl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-1838.24789016; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2sptf5singleteBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-1018.11688688; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2spdph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-870.504849225; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2soso3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-714.877852624; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2smosh3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-1663.79400678; Eh
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