PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

bismuth selenide   8222 Bismuth selenide

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    #  Species Formula
  8212 Bismuth trichloride (Geo)Cl3Bi
  8213 Bismuth trichlorideCl3Bi
  8214 Bi(III)Cl4(-) (FERCBI10) (Geo)Cl4Bi
  8215 Bi(III)Cl4(-) (FERCBI10)Cl4Bi
  8216 BiCl4(-)Cl4Bi
  8217 BiCl4(-) (Geo)Cl4Bi
  8218 BiCl6(-)Cl6Bi
  8219 BiCl6(-) (Geo)Cl6Bi
  8220 Bi(III)Cl6(3-) (ACAYAF) (Geo)Cl6Bi
  8221 Bi(III)Cl6(3-) (ACAYAF)Cl6Bi
  8222 Bismuth selenide SeBi
  8223 Bi(III)CN2Br2 (BIMHUA) (Geo)C16H15N2Br2Bi
  8224 Bi(III)CN2Br2 (BIMHUA)C16H15N2Br2Bi
  8225 Bismuth tribromide (Geo)Br3Bi
  8226 Bismuth tribromideBr3Bi
  8227 Bi(III)S4Br3 (KIGDIN) (Geo)C8H20S4Br3Bi
  8228 Bi(III)S4Br3 (KIGDIN)C8H20S4Br3Bi
  8229 Bi(III)Br6(3-) (DEJLUZ) (Geo)Br6Bi
  8230 Bi(III)Br6(3-) (DEJLUZ)Br6Bi
  8231 Bi(III)Cl2I2(-) (JAJFEG) (Geo)Cl2I2Bi
  8232 Bi(III)Cl2I2(-) (JAJFEG)Cl2I2Bi


ΔHf: 42.0 kcal/mol,     REF: D. D. Wagman, W. H. Evans, V. B. Parker, R. H. Schumm, I. Halow, S. M. Bailey, K. L. Churney, R. L. Nuttall, J. Phys. Chem. Ref. Data Suppl. 11, 2 (1982).
  
 GEO-OK FIELD=(0.1,0.2,0.3) PM7
Bismuth selenide
 H=42 HR=WEPS1982
 Bi     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Se     2.32191577 +1    0.0000000 +0    0.0000000 +0     1     0     0