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 oincl2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-997.683594261; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes saucl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-1914.68385673; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes piridinacrh2o5tripleteBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-717.006822177; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2sfecl3baiBesora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1904.06584588; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2sgacl3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-1782.21821192; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes ph3hgi2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-519.613266807; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes h2shgi2Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-575.858752304; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes ph3fecl3-Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYP6-31+g*; sdd-1847.95256584; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes ph3ptph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+g*; sdd-805.741941411; Eh
thumbnail.jpeg9-Nov-2018/vacuum/complexes oniph3Besora, MariaGaussian; 09; EM64L-G09RevD.01Single point TSRB3LYP6-31+g*; sdd-589.191368880; Eh
Results 5021-5030 of 12842 (Search time: 0.005 seconds).