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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg16-Mar-2021N1+_cS_SVPSchön, FlorianGaussian; 16; ES64L-G16RevB.01Single point StructureRTPSShDEF2SVP-
thumbnail.jpeg16-Mar-20211tsI_cS_SVPSchön, FlorianGaussian; 16; ES64L-G16RevC.01Single point StructureRTPSShDEF2SVP-
thumbnail.jpeg16-Mar-20211intII_cS_SVPSchön, FlorianGaussian; 16; ES64L-G16RevC.01Single point StructureRTPSShDEF2SVP-
thumbnail.jpeg3-May-2019Ru-2-VAC-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureRTPSShlanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-1801.39498429; Eh
thumbnail.jpeg3-May-2019Ru-9-VAC-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureRTPSShlanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-1908.24207322; Eh
thumbnail.jpeg3-May-2019Ru-3-VAC-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureRTPSShlanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-1540.69336406; Eh
thumbnail.jpeg3-May-2019Ni-17-VAC-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureRTPSShlanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-2305.35690425; Eh
thumbnail.jpeg3-May-2019Fe-13-OH-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureRTPSShlanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-2495.79109798; Eh
thumbnail.jpeg3-May-2019Co-16-OH-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureRTPSShlanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-1765.12275708; Eh
thumbnail.jpeg3-May-2019Co-16-OOH-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureRTPSShlanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-1840.26157846; Eh
Results 1-10 of 16 (Search time: 0.002 seconds).