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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Jan-2024/model_system TS4_H-cis-chair-outGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPGENECP-1553.80811628; Eh
thumbnail.jpeg9-Jan-2024/model_system TS4_H-trans-boat-outGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPGENECP-1553.80137882; Eh
thumbnail.jpeg9-Jan-2024/model_system TS5_H-cis-chair-outGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPGENECP-1553.81021148; Eh
thumbnail.jpeg9-Jan-2024/model_system TS4_H-cis-boat-outGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPGENECP-1553.80517408; Eh
thumbnail.jpeg9-Jan-2024/model_system TS4_H-trans-chair-inGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPGENECP-1553.80664483; Eh
thumbnail.jpeg9-Jan-2024/model_system TS4_H-cis-boat-inGuo, WentaoGaussian; 09; AM64L-G09RevD.01Geometry optimization TSRB3LYPGENECP-1553.80492250; Eh
thumbnail.jpeg9-Jan-2024/model_system TS5_H-cis-chair-inGuo, WentaoGaussian; 16; ES64L-G16RevB.01Geometry optimization TSRB3LYPGENECP-1553.81016789; Eh
thumbnail.jpeg9-Jan-2024/model_system TS12_H-trans_Guo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPGENECP-1553.82740607; Eh
thumbnail.jpeg9-Jan-2024/model_system TS11_H-transGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPGENECP-1553.84207375; Eh
thumbnail.jpeg9-Jan-2024/model_system TS10_H-transGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRB3LYPGENECP-1553.83786435; Eh
Results 51-60 of 72 (Search time: 0.001 seconds).