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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg3-May-2019tpssh-Co-16-H2O-II-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUTPSShlanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-1765.75801030; Eh
thumbnail.jpeg3-May-2019tpssh-Co-16-OH-III-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-2019bp86-Co-16-H2O-II-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUBP86lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-1765.76085449; Eh
thumbnail.jpeg3-May-2019bp86-Co-16-OH-III-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureRBP86lanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-1765.15919352; 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-2019Cu-15-VAC-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUTPSShlanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-1353.55008410; Eh
thumbnail.jpeg1-Jul-2019/dispersion/Ru_4/Evac dispersion_Ru-4-VAC-freqCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1429.4173252; Eh
thumbnail.jpeg3-May-2019tpssh-Ru-2-H2O-II-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureRTPSShlanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-1877.84137545; 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
thumbnail.jpeg3-May-2019Cu-15-OH-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureRTPSShlanl2dz; 6-31g(d); 6-31g(d,p); 6-31+g(d)-1429.33974887; Eh
Results 91-100 of 153 (Search time: 0.002 seconds).