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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg14-Mar-2024/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M9Foscato, MarcoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBEPBEGEN-2293.57735186; Eh
thumbnail.jpeg14-Mar-2024/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M5Foscato, MarcoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRHF; RPBEPBEGEN-1451.6139691; Eh
thumbnail.jpeg14-Mar-2024/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M8Foscato, MarcoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBEPBEGEN-1499.99123310; Eh
thumbnail.jpeg14-Mar-2024/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M6Foscato, MarcoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBEPBEGEN-2300.50126179; Eh
thumbnail.jpeg14-Mar-2024/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M17Foscato, MarcoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-1493.0227482; Eh
thumbnail.jpeg14-Mar-2024/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M15Foscato, MarcoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-1493.0208662; Eh
thumbnail.jpeg14-Mar-2024/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M22Foscato, MarcoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-1147.9701741; Eh
thumbnail.jpeg14-Mar-2024/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M16Foscato, MarcoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-1492.9893135; Eh
thumbnail.jpeg14-Mar-2024/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M20Foscato, MarcoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-1146.2682235; Eh
thumbnail.jpeg14-Mar-2024/PBEPBE_GD3MBJ_SMDwater_def2_TZVP M21Foscato, MarcoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-1146.2620486; Eh
Results 271-280 of 353 (Search time: 0.001 seconds).