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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-May-2019INT5_m06spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRM062X--3100.3195763; Eh
thumbnail.jpeg2-May-2019INT9_m06spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRM062X--3100.3435903; Eh
thumbnail.jpeg2-May-2019TS6_m06spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRM062X--3176.7498742; Eh
thumbnail.jpeg2-May-2019INT4noa_m06spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRM062X--2679.6154596; Eh
thumbnail.jpeg2-May-2019catalyst_H2O_m06spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRM062X--2024.4089164; Eh
thumbnail.jpeg2-May-2019INT3_m06spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRM062X--3176.7381856; Eh
thumbnail.jpeg2-May-2019TS2_m06spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRM062X--3176.7293936; Eh
thumbnail.jpeg2-May-2019reactant_S_m06spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRM062X--731.6209519; Eh
thumbnail.jpeg2-May-2019TS1_m06spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRM062X--3176.7359402; Eh
thumbnail.jpeg2-May-2019INT8_m06spBesora, MariaGaussian; 09; EM64L-G09RevA.02Single point StructureRM062X--2679.6268363; Eh
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