Accuracy

xeclr   6260 Xenon chloride, anion (Geo)

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    #  Species Formula
  6250 Te(IV)I6(2-) (IZOWAV)Te2I10
  6251 Xenon, cationXe
  6252 Xenon, atomXe
  6253 Xenon Lithium, cation (Geo)LiXe
  6254 Xenon tetroxideO4Xe
  6255 Xenon tetroxide (Geo)O4Xe
  6256 Xenon fluoride, anion (Geo)FXe
  6257 Xenon tetrafluoride (Geo)F4Xe
  6258 Xenon tetrafluorideF4Xe
  6259 Xenon sodium, cation (Geo)NaXe
  6260 Xenon chloride, anion (Geo) ClXe
  6261 Xenon potassium, cation (Geo)KXe
  6262 Xenon bromide, anion (Geo)BrXe
  6263 Xenon iodide, anion (Geo)IXe
  6264 Cesium, cationCs
  6265 Cesium, 2P(u) - 6s(0)6p(1)Cs
  6266 Cesium, 2S(g) - 6s(1)6p(0)Cs
  6267 Cesium, atomCs
  6268 Cesium, anionCs
  6269 Methyl cesium (Geo)CH3Cs
  6270 Methyl cesiumCH3Cs


REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
  
 CHARGE=-1 PM7
Xenon chloride, anion
 <Xe-Cl> GR=PW91D
 Xe     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     3.90200000 +1    0.0000000 +0    0.0000000 +0     1     0     0