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12.5 Lattice of point charges

LAT,$x,y,z,q$;

Immediately following the Z-matrix specification may appear one or more ``LAT'' cards, defining a lattice of point charges. $x,
y, z$ are the cartesian coordinates and $q$ the charge of the point. Note that internal coordinates may not be used, and that only the symmetry unique lattice points should be defined.



P.J. Knowles and H.-J. Werner
molpro-support@tc.bham.ac.uk
Mar 8, 2000