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 1 Helium-containing Solids predicted using PM7 with X-Ray

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

Average unsigned error in PM7 HoF: 0.10 kcal/mol, for 1 solids
Average unsigned error in PM6 HoF: 0.00 kcal/mol, for 1 solids

     #     GUI   Heat of formation (Kcal/formula unit) Geometry        Species
                    Ref.        PM7        PM6        PM7    PM6 
     1   (JSmol)     0.0        -0.1        0.0        0.0    0.0  Helium (He) (ICSD 44396)