28.4.1 Dipole fields (DIP)

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28.4.1 Dipole fields (`DIP`)

DIP,xfield,yfield,zfield;
DIP+,xfield,yfield,zfield;

Add a finite dipole field to the one electron Hamiltonian and the core energy. The field strength is given by xfield,yfield,zfield. DIP+ adds to any existing field, otherwise any previous field is removed.

P.J. Knowles and H.-J. Werner
molpro@tc.bham.ac.uk
Jan 15, 2002