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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Feb-2023/enamine 1c_DCMGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRM062X6-31G(D,P)-1885.70493528; Eh
thumbnail.jpeg9-Feb-2023/enone INT1aGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRM062X6-31G(D,P)-1826.96239879; Eh
thumbnail.jpeg9-Feb-2023/enone 2aGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRM062X6-31G(D,P)-1827.00548483; Eh
thumbnail.jpeg9-Feb-2023/enone 1aGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRM062X6-31G(D,P)-1826.97578153; Eh
thumbnail.jpeg9-Feb-2023/H INT1bGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRM062X6-31G(D,P)-1674.36348823; Eh
thumbnail.jpeg9-Feb-2023/H 2bGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRM062X6-31G(D,P)-1674.41787937; Eh
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