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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Apr-2019HFFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G**-100.4864764; Eh
thumbnail.jpeg30-Apr-2019c8Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G**-2498.2573648; Eh
thumbnail.jpeg30-Apr-2019Int-FFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G**-1363.390141; Eh
thumbnail.jpeg30-Apr-20192kFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G**-1262.9033068; Eh
thumbnail.jpeg30-Apr-20191kFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G**-1363.3129165; Eh
thumbnail.jpeg30-Apr-2019c5-pFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G**-2537.5899473; Eh
thumbnail.jpeg30-Apr-2019Ms_c2SFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G**-2267.0917983; Eh
thumbnail.jpeg30-Apr-2019Ms_c1FFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G**-2267.0503861; Eh
thumbnail.jpeg30-Apr-2019Ms_c1Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G**-2267.056465; Eh
thumbnail.jpeg30-Apr-20193gFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311+G**-1402.6413397; Eh
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