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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg12-Nov-2019H6PtW6O24(3e_3H-Pt)Lang, ZhonglingGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUM066-31G(D) 6-31G(D,P) LANL2DZ GEN-2337.27899309; Eh
thumbnail.jpeg12-Nov-2019H6PtW6O24(4e_4H-Pt)Lang, ZhonglingGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUM066-31G(D) 6-31G(D,P) LANL2DZ GEN-2337.82414427; Eh
thumbnail.jpeg12-Nov-2019H6PtW6O24(3e_3H-O)Lang, ZhonglingGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUM066-31G(D) 6-31G(D,P) LANL2DZ GEN-2337.27501553; Eh
thumbnail.jpeg12-Nov-2019H6PtW6O24(2e_2H)-H2Lang, ZhonglingGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM066-31G(D) 6-31G(D,P) LANL2DZ GEN-2336.64659385; Eh
thumbnail.jpeg12-Nov-2019H6PtW6O24(2e_2H)Lang, ZhonglingGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM066-31G(D) 6-31G(D,P) LANL2DZ GEN-2336.73112094; Eh
thumbnail.jpeg12-Nov-2019TS-4e-4HLang, ZhonglingGaussian; 09; ES64L-G09RevD.01Geometry optimization TSUM066-31G(D) 6-31G(D,P) LANL2DZ GEN-2337.81787444; Eh
thumbnail.jpeg12-Nov-2019TS-3e-3HLang, ZhonglingGaussian; 09; ES64L-G09RevD.01Geometry optimization TSUM066-31G(D) 6-31G(D,P) LANL2DZ GEN-2337.21884799; Eh
thumbnail.jpeg12-Nov-2019H2-S3-from-_H6PtW6O24_4e_4H(Pt)Lang, ZhonglingGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUM066-31G(D) 6-31G(D,P) LANL2DZ GEN-2337.86196562; Eh
thumbnail.jpeg12-Nov-2019H2-S1-from-_H6PtW6O24_4e_4H(Pt)Lang, ZhonglingGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM066-31G(D) 6-31G(D,P) LANL2DZ GEN-2337.88047457; Eh
thumbnail.jpeg12-Nov-2019IRC-TS-3e_3HLang, ZhonglingGaussian; 09; ES64L-G09RevD.01Single point Structure-6-31G(D) 6-31G(D,P) LANL2DZ-2337.25490668; Eh
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