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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Apr-2021/models_type1/species_2a sextet_tzvpMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2TZVP-2554.89341602; Eh
thumbnail.jpeg30-Apr-2021/models_type1/species_1 doublet_tzvpMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2TZVP-2555.36233635; Eh
thumbnail.jpeg30-Apr-2021/models_type1/species_B sextet_tzvpMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2TZVP-2478.40922046; Eh
thumbnail.jpeg30-Apr-2021/models_type1/species_1 sextet_tzvpMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2TZVP-2555.35694001; Eh
thumbnail.jpeg30-Apr-2021/models_type2/species_A quartet_sv-pMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-2553.73680431; Eh
thumbnail.jpeg30-Apr-2021/models_type2/species_1 sextet_sv-pMariusz, RadonGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-2782.84241395; Eh
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
Results 81-90 of 116 (Search time: 0.0 seconds).