#
#  WOODLEY - potential for spherical or non spherical Mn3+
#
#  from S.M.Woodley, C.R.A.Catlow, J.D.Gale and P.D.Battle
#  Chem. Commun., 1879 (2000).
#
#  A new ligand field type force to enable distorted environments
#  about open shell d-metals: parameters and details given in 
#  publication given above. More details will be published shortly.
#
#  The O-O potential parameters are identical to those given
#  by Bush 1994. 
#
species
La core  3.000
Mn core  3.000
O  core  0.513
O  shel -2.513
buck
La core O shel 4317.17 0.2987  0.0  0.0 10.0
Mn core O shel 1265.17 0.3176  0.0  0.0 10.0
O  shel O shel   25.41 0.6937 32.32 0.0 12.0
aolm
Mn core O core    8.98 0.3300  3 1  0.0 10.0
spring
O 20.53