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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg15-Nov-2022CFCl3_NRCastro, Abril C.Gaussian; 16; ES64L-G16RevC.01Single point StructureRPBEPBE; RPBE1PBEGEN-1518.068577; Eh
thumbnail.jpeg15-Nov-20221pF-d(solid)_NRCastro, Abril C.Gaussian; 16; ES64L-G16RevC.01Single point StructureRPBEPBEGENECP-4132.8418781; Eh
thumbnail.jpeg15-Nov-20221oF-d(solid)_NRCastro, Abril C.Gaussian; 16; ES64L-G16RevC.01Single point StructureRPBEPBEGENECP-4132.8159249; Eh
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