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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg25-Jul-2022/fe_c6h12/quartet fe-c6h11oh-4Skjelstad, Bastian BjerkemGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumUTPSShDEF2SVP DEF2TZVP-7684.5502637; Eh
thumbnail.jpeg25-Jul-2022/ru_c6h12/quartet ru-c6h11oh-4Skjelstad, Bastian BjerkemGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumUTPSShDEF2SVP DEF2TZVP-6515.6481382; Eh
thumbnail.jpeg25-Jul-2022/fe_c6h12/sextet fe-cpcm_c6h12-6Skjelstad, Bastian BjerkemGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUTPSShDEF2SVP DEF2TZVP-7373.2883157; Eh
thumbnail.jpeg25-Jul-2022/fe_ch4/quartet feo-ch4-4Skjelstad, Bastian BjerkemGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUTPSShDEF2SVP DEF2TZVP-7489.0520982; Eh
thumbnail.jpeg25-Jul-2022/fe fe_2Skjelstad, Bastian BjerkemGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUTPSShDEF2SVP DEF2TZVP-7448.4941906; Eh
thumbnail.jpeg25-Jul-2022/mn mn_7Skjelstad, Bastian BjerkemGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUTPSShDEF2SVP DEF2TZVP-7335.7625316; Eh
thumbnail.jpeg25-Jul-2022/tc tc_5Skjelstad, Bastian BjerkemGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUTPSShDEF2SVP DEF2TZVP-6265.6384374; Eh
thumbnail.jpeg25-Jul-2022/rh rh_5Skjelstad, Bastian BjerkemGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUTPSShDEF2SVP DEF2TZVP-6295.2382329; Eh
thumbnail.jpeg25-Jul-2022/fe_c6h12/quartet fe-cpcm_c6h12-4Skjelstad, Bastian BjerkemGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUTPSShDEF2SVP DEF2TZVP-7373.2864151; Eh
thumbnail.jpeg25-Jul-2022/fe_c6h12/sextet fe-c6h11oh-6Skjelstad, Bastian BjerkemGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumUTPSShDEF2SVP DEF2TZVP-7684.513414; Eh
Results 81-90 of 97 (Search time: 0.002 seconds).