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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Apr-2021/models_type3/species_2a quartet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-5794.15355511; Eh
thumbnail.jpeg30-Apr-2021/models_type3/species_A sextet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-5565.50491739; Eh
thumbnail.jpeg30-Apr-2021/models_type3/species_Y singlet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRB3LYPDEF2SV DEF2SVP GEN-5694.83599546; Eh
thumbnail.jpeg30-Apr-2021/models_type3/species_2b sextet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-5794.13984798; Eh
thumbnail.jpeg30-Apr-2021/models_type3/species_2b doublet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-5794.14997780; Eh
thumbnail.jpeg30-Apr-2021/models_type3/species_1 sextet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-5794.62072102; Eh
thumbnail.jpeg30-Apr-2021/models_type3/species_3 quartet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-5793.66572956; Eh
thumbnail.jpeg30-Apr-2021/models_type3/species_B sextet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-5565.02941001; Eh
thumbnail.jpeg30-Apr-2021/models_type3/species_B doublet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-5565.02926996; Eh
thumbnail.jpeg30-Apr-2021/models_type3/species_2a sextet_sv-pMariusz, RadonGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SV DEF2SVP GEN-5794.15108366; Eh
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