HoF Errors: < 2 kcal/mol   < 5 kcal/mol   < 10 kcal/mol   < 20 kcal/mol   < 50 kcal/mol.   Geometries: 0: good, 100: bad

Comparison of Structures of 6 Europium-containing Solids predicted using PM7 with X-Ray

(All solids - Periodic Table - Home - PM7 Accuracy - Manual) 

     #     GUI   Heat of formation (Kcal/formula unit) Geometry        Species
                    Ref.        PM7        PM6        PM7    PM6
  1879   (JSmol)               463.0      209.0        9.3   13.6  Eu Complex Sparkle (EGOBEH)
  1880   (JSmol)                33.6     -101.5       19.8   21.9  Eu Complex Sparkle (PIEUAC01)
  1881   (JSmol)              -265.5     -369.7       17.0   36.9  Eu Complex Sparkle (ICSD 280528)
  1882   (JSmol)             -1367.1    -1349.8       22.0   23.5  Eu Complex Sparkle (BUVXAR11)
  1883   (JSmol)              -421.6     -558.2        9.8   23.8  Eu Complex Sparkle (FUXPOD)
  1884   (JSmol)              -513.2     -565.4       12.5   17.3  Eu Complex Sparkle (QAKWUU)