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11.2.9 grid_obtain_gradwt: obtain a block of grid weight derivatives

      subroutine grid_obtain_gradwt(icatom,npt,xyz,wt,jwt,dwt)
      implicit double precision (a-h,o-z)
      include "common/cgeom"
      dimension xyz(3,ncen), wt(npt),dwt(3,ncen,npt)
Obtain a block of weight derivatives.
iatom
atom identifier -- must be supplied on input.
npt
number of grid points in block -- must be supplied on input.
xyz
cartesian coordinates of the grid points -- must be supplied on input.
wt
integration weights -- must be supplied on input.
jwt
on entry, the type of weight.
dwt
on exit, the weight derivatives with respect to nuclear motion.


Subsections

P.J. Knowles and H.-J. Werner
molpro-support@tc.bham.ac.uk
Jan 10, 2000