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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg25-Feb-2021//m06l_molsimps/Co_3a1_3_ OH//m06l_molsimps/Co_3a1_3_/OH LS Co_3a1_3_OH_LSm06lCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUM06L6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D) GEN-1629.3942338; Eh
thumbnail.jpeg25-Feb-2021//m06l_molsimps/Co_3a1_29 VAC//m06l_molsimps/Co_3a1_29/VAC HS Co_3a1_29_VAC_HSm06lCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUM06L6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D) GEN-1419.6282889; Eh
thumbnail.jpeg25-Feb-2021//m06l_molsimps/Co_3a1_2_ OOH//m06l_molsimps/Co_3a1_2_/OOH LS Co_3a1_2_OOH_LSm06lCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUM06L6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D) GEN-1858.1577747; Eh
thumbnail.jpeg25-Feb-2021//m06l_molsimps/Co_3a1_2_ OH//m06l_molsimps/Co_3a1_2_/OH LS Co_3a1_2_OH_LSm06lCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUM06L6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D) GEN-1783.0276448; Eh
thumbnail.jpeg25-Feb-2021//m06l_molsimps/Co_3a1_29 OOH//m06l_molsimps/Co_3a1_29/OOH LS Co_3a1_29_OOH_LSm06lCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUM06L6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D) GEN-1570.5884687; Eh
thumbnail.jpeg25-Feb-2021//m06l_molsimps/Co_3a1_29 OH//m06l_molsimps/Co_3a1_29/OH LS Co_3a1_29_OH_LSm06lCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUM06L6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D) GEN-1495.4544917; Eh
thumbnail.jpeg25-Feb-2021//m06l_molsimps/Co_3a1_13 VAC//m06l_molsimps/Co_3a1_13/VAC HS//m06l_molsimps/Co_3a1_13/VAC/HS forw Co_3a1_13_VAC_HS-f_3e-1m06lCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUM06L6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D) GEN-1854.5584013; Eh
thumbnail.jpeg25-Feb-2021//m06l_molsimps/Co_3a1_13 OOH//m06l_molsimps/Co_3a1_13/OOH LS Co_3a1_13_OOH_LSm06lCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUM06L6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D) GEN-2005.5191621; Eh
thumbnail.jpeg25-Feb-2021//m06l_molsimps/Co_3a1_17 OOH//m06l_molsimps/Co_3a1_17/OOH LS Co_3a1_17_OOH_LSm06lCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUM06L6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D) GEN-1819.8674913; Eh
thumbnail.jpeg25-Feb-2021//m06l_molsimps/Co_3a1_17 VAC//m06l_molsimps/Co_3a1_17/VAC HS Co_3a1_17_VAC_HSm06lCraig, MichaelGaussian; 09; ES64L-G09RevE.01Single point StructureUM06L6-31G(D,P) 6-31G(D) LANL2DZ 6-31+G(D) GEN-1668.9119197; Eh
Results 531-540 of 557 (Search time: 0.002 seconds).