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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Jun-2021/new_complexes Complex_21_H2Ortuño Maqueda, Manuel AngelGaussian; 09; AS64L-G09RevD.01Geometry optimization MinimumRM06SDD 6-31G(D) 6-31G(D,P) GEN-3602.63826207; Eh
thumbnail.jpeg30-Jun-2021/new_complexes Complex_21_HOrtuño Maqueda, Manuel AngelGaussian; 09; AS64L-G09RevD.01Geometry optimization MinimumRM06SDD 6-31G(D) 6-31G(D,P) GEN-3602.32579933; Eh
thumbnail.jpeg30-Jun-2021/new_complexes Complex_23_H2Ortuño Maqueda, Manuel AngelGaussian; 09; AS64L-G09RevD.01Geometry optimization MinimumRM06SDD 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-3546.35366558; Eh
thumbnail.jpeg30-Jun-2021/new_complexes Complex_23_HOrtuño Maqueda, Manuel AngelGaussian; 09; AS64L-G09RevD.01Geometry optimization MinimumRM06SDD 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-3546.04783790; Eh
thumbnail.jpeg30-Jun-2021/new_complexes Complex_22_HOrtuño Maqueda, Manuel AngelGaussian; 09; AS64L-G09RevD.01Geometry optimization MinimumRM06SDD 6-31G(D) 6-31+G(D) 6-31G(D,P) GEN-3582.94720947; Eh
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