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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg24-Jun-2019Mo-ts-7-8Artus Suarez, LluisGaussian; 09; ES64L-G09RevD.01Geometry optimization TSRM066-31+G** GENECP-2265.93782634; Eh
thumbnail.jpeg24-Jun-2019Mo-ts-14-15Artus Suarez, LluisGaussian; 09; ES64L-G09RevD.01Geometry optimization TSRM066-31+G** GENECP-1941.61009948; Eh
thumbnail.jpeg24-Jun-2019Mo-9bArtus Suarez, LluisGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM066-31+G** GENECP-1979.75973133; Eh
thumbnail.jpeg27-Aug-2019Mo-4-alt3Artus Suarez, LluisGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM066-31+G** GENECP-2487.85481184; Eh
thumbnail.jpeg22-Mar-2020/M06_BS1_optimized_structures ga_m06_dmadprodrG. Algarra, AndrésGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM066-31G(D,P) SDDALL GEN-2965.91065349; Eh
thumbnail.jpeg22-Mar-2020/M06_BS1_optimized_structures m06_pha_prod1G. Algarra, AndrésGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM066-31G(D,P) SDDALL GEN-2741.27305231; Eh
thumbnail.jpeg22-Mar-2020/M06_BS1_optimized_structures m06_pha_ts1aG. Algarra, AndrésGaussian; 09; ES64L-G09RevD.01Geometry optimization TSRM066-31G(D,P) SDDALL GEN-2741.23843178; Eh
thumbnail.jpeg22-Mar-2020/M06_BS1_optimized_structures ga_m06_dmadG. Algarra, AndrésGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM066-31G(D,P) GEN-532.773931951; Eh
thumbnail.jpeg22-Mar-2020/M06_BS1_optimized_structures m06_phaG. Algarra, AndrésGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM066-31G(D,P) GEN-308.144672628; 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
Results 21-30 of 244 (Search time: 0.002 seconds).