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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required1-Jul-2019/dispersion/Ru_7/Eo4 dispersion_Ru-7-O4Craig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1784.4387394; Eh
Login required1-Jul-2019/dispersion/Ru_8/Eo dispersion_Ru-8-OCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-2396.1383518; Eh
Login required1-Jul-2019/dispersion/Ru_1/evac dispersion_Ru-1-VAC-dispersionCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1769.4606841; Eh
Login required1-Jul-2019/dispersion/dimers/Ru_3 dispersion_Ru-3-O-O-dimer-bb-dispersionCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-3231.5254714; Eh
Login required1-Jul-2019/dispersion/Ru_5/Eooh dispersion_Ru-5-OOH-freq-dispCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1693.7813455; Eh
Login required1-Jul-2019/dispersion/Mn_10/Eooh dispersion_Mn-10-OOH-freqCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1417.7673464; Eh
Login required1-Jul-2019/dispersion/Fe_14/Evac dispersion_Fe-14-VAC-freqCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1041.7721768; Eh
Login required1-Jul-2019/dispersion/Fe_14/Eoh dispersion_Fe-14-OH-freqCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-1117.619962; Eh
Login required1-Jul-2019/dispersion/Ru_8/Eoh dispersion_Ru-8-OH-freqCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-2396.7805033; Eh
Login required1-Jul-2019/dispersion/Ni_17/Eoh dispersion_Ni-17-OH-freqCraig, MichaelGaussian; 09; EM64L-G09RevA.02Single point StructureUTPSShLANL2DZ 6-31G(D) 6-31G(D,P) 6-31+G(D) GEN-2381.2899926; Eh
Results 31-40 of 83 (Search time: 0.001 seconds).