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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg7-Nov-2023opt_pFRuCl2_0_1Mollfulleda, RosaADF; 2019; 307Single point QuildS12g-x PBEcTZ2P-
thumbnail.jpeg7-Nov-2023opt_Ru1pF_0_4Mollfulleda, RosaADF; 2019; 307Single point QuildS12g-x PBEcTZ2P-
thumbnail.jpeg7-Nov-2023opt_Ru1pF_0_2Mollfulleda, RosaADF; 2019; 307Single point QuildS12g-x PBEcTZ2P-
thumbnail.jpeg7-Nov-2023opt_pFRu2_0_1Mollfulleda, RosaADF; 2019; 307Single point QuildS12g-x PBEcTZ2P-
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