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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg27-Jul-2021/TS_oxo_OH_Cy Fe-oxo-H-reprot-scan-tsPeñas-Defrutos, Marconi N.Gaussian; 09; ES64L-G09RevE.01Geometry optimization TSUwB97XDLANL2DZ 6-31G(D,P) 6-31G(D) 6-31+G(D) GEN-1983.92914324; Eh
thumbnail.jpeg27-Jul-2021/TS_oxo_OH_Mes Fe-oxo-Mes-H-ts-F-ts3Peñas-Defrutos, Marconi N.Gaussian; 09; ES64L-G09RevE.01Geometry optimization TSUwB97XDLANL2DZ 6-31G(D,P) 6-31G(D) 6-31+G(D) GEN-2326.75086663; Eh
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