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17.1.7 Options for polarizabilities

POLARI=value
If nonzero, compute analytical dipole polarizabilities. See also the POLARI directive (section 17.8), which allows to specify various one-electron operators (by default, the dipole operator is used).
THRCPHF=thresh
Threshold for CPHF if polarizabilities are computed (default 1.d-6).



molpro@molpro.net
Sep 24, 2008