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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg1-Feb-2019defect-T-2H-ethylene-TS_(T-TS5)Ortuño, Manuelvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Nov 06 2018 10:40:09) gamma-onlyFrequenciesDFT--4802.99501147; eV
thumbnail.jpeg1-Feb-2019defect-T-2H-ethylene_(T-5)Ortuño, Manuelvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Nov 06 2018 10:40:09) gamma-onlyFrequenciesDFT--4803.29053135; eV
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