http://www.csc.fi/gopenmol/
) is driven by the keyword
$pointval. This keyword is evaluated by all density matrix generating
TURBOMOLE modules, i.e. by dscf, ridft, rimp2 mpgrad, ricc2
(see Section 9.3.3) and egrad.
Note, that all of the following quantities may be calculated simultaneusly, and
that for programs dscf, ridft, rimp2 and mpgrad the density matrix
generating steps may be skipped by typing "<program> -proper
".