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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg8-Jan-2024im3-cis-tzPhung, QuanGaussian; 16; ES64L-G16RevC.02Single point StructureUB3LYPDEF2TZVP-2468.5867125; Eh
thumbnail.jpeg8-Jan-2024cis-tzPhung, QuanGaussian; 16; ES64L-G16RevC.02Single point StructureUB3LYPDEF2TZVP-2468.6198806; Eh
thumbnail.jpeg8-Jan-2024im1-tzPhung, QuanGaussian; 16; ES64L-G16RevC.02Single point StructureUB3LYPDEF2TZVP-2468.5915684; Eh
thumbnail.jpeg8-Jan-2024im2-tzPhung, QuanGaussian; 16; ES64L-G16RevC.02Single point StructureUB3LYPDEF2TZVP-2468.5921096; Eh
thumbnail.jpeg8-Jan-2024cisb-cisc-tzPhung, QuanGaussian; 16; ES64L-G16RevC.02Single point StructureUB3LYPDEF2TZVP-2468.6196978; Eh
thumbnail.jpeg8-Jan-2024cisc-cisd-tzPhung, QuanGaussian; 16; ES64L-G16RevC.02Single point StructureUB3LYPDEF2TZVP-2468.619555; Eh
thumbnail.jpeg8-Jan-2024cisa-cisb-tzPhung, QuanGaussian; 16; ES64L-G16RevC.02Single point StructureUB3LYPDEF2TZVP-2468.6235367; Eh
thumbnail.jpeg8-Jan-2024cisd-cis-tzPhung, QuanGaussian; 16; ES64L-G16RevC.02Single point StructureUB3LYPDEF2TZVP-2468.618912; Eh
thumbnail.jpeg8-Jan-2024cisc-tzPhung, QuanGaussian; 16; ES64L-G16RevC.02Single point StructureUB3LYPDEF2TZVP-2468.6204448; Eh
thumbnail.jpeg8-Jan-2024cisb-tzPhung, QuanGaussian; 16; ES64L-G16RevC.02Single point StructureUB3LYPDEF2TZVP-2468.6244882; Eh
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