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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg29-Mar-2023/uv opt_ncpDMF_3dep_DMFMartins, FredericoADF; 2019; 304Geometry optimization QuildS12g-x PBEcTZ2P-
thumbnail.jpeg29-Mar-2023/uv opt_ncpDMF_DMFMartins, FredericoADF; 2019; 304Geometry optimization QuildS12g-x PBEcTZ2P-
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