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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Apr-2021/models_type2/species_B quartet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-2553.26442104; Eh
thumbnail.jpeg30-Apr-2021/models_type2/species_3 sextet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-2781.89716862; Eh
thumbnail.jpeg30-Apr-2021/models_type1/species_3 quartet_sv-pMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-2552.77716686; Eh
thumbnail.jpeg30-Apr-2021/models_type1/species_B quartet_sv-pMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-2476.89845432; Eh
thumbnail.jpeg30-Apr-2021/models_type2/species_1 doublet_tzvpMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2TZVP-2784.81719936; Eh
thumbnail.jpeg30-Apr-2021/models_type2/species_A doublet_sv-pMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-2553.72678669; Eh
thumbnail.jpeg30-Apr-2021/models_type0/species_2a_and_3 doublet_tzvpMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2TZVP-2385.13861230; Eh
thumbnail.jpeg30-Apr-2021/models_type2/species_B doublet_sv-pMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-2553.25956631; Eh
thumbnail.jpeg30-Apr-2021/models_type1/species_A doublet_sv-pMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-2477.36048629; Eh
thumbnail.jpeg30-Apr-2021/models_type2/species_3 quartet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-2781.89648804; Eh
Results 71-80 of 97 (Search time: 0.0 seconds).