Search        

Current filters:
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg11-May-20213BbisFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUM066-31+G(D) GENECP-1275.55379673; Eh
thumbnail.jpeg11-May-2021MECP-3C-osC-singletFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureUM066-31+G(D) GENECP-1275.55942465; Eh
thumbnail.jpeg11-May-2021MECP-3C-osC-tripletFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureUM066-31+G(D) GENECP-1275.55946826; Eh
thumbnail.jpeg11-May-2021MECP-B-3B-singletFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureUM066-31+G(D) GENECP-1275.55704755; Eh
thumbnail.jpeg11-May-20213CFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUM066-31+G(D) GENECP-1275.55947030; Eh
thumbnail.jpeg11-May-20213BFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUM066-31+G(D) GENECP-1275.56054450; Eh
thumbnail.jpeg11-May-2021BFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUM066-31+G(D) GENECP-1275.58678162; Eh
thumbnail.jpeg11-May-2021MECP-B-3B-tripletFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Single point StructureUM066-31+G(D) GENECP-1275.55702336; Eh
thumbnail.jpeg11-May-2021TS-3B-AFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization TSUM066-31+G(D) GENECP-1275.55904047; Eh
thumbnail.jpeg11-May-2021TS-3B-3CFondevila, Adiran J. De AguirreGaussian; 09; EM64L-G09RevD.01Geometry optimization TSUM066-31+G(D) GENECP-1275.55303382; Eh
Results 1-10 of 33 (Search time: 0.0 seconds).