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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg6-Nov-2020/Cluster-Fe-MOF-74 M06-L-H₂Morales-Vidal, JordiGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM06L6-31G** GEN-1.17026402271; Eh
thumbnail.jpeg6-Nov-2020/Cluster-Fe-MOF-74 M06-L-H₂OMorales-Vidal, JordiGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM06L6-31G** 6-31+G* GEN-76.4197038398; Eh
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