$CISORT group (relevant for GUGA -CI- or -MCSCF-) This group provides further control over the sorting of the transformed molecular integrals into the order the GUGA program requires. NDAR = Number of direct access records. (default = 2000) LDAR = Length of direct access record (site dependent) NBOXMX = Maximum number of boxes in the sort. (default = 200) NWORD = Number of words of fast memory to use in this step. A value of 0 results in automatic use of all available memory. (default = 0) NOMEM = 0 (set to one to force out of memory algorithm) ========================================================== $GUGEM group (relevant for GUGA -CI- or -MCSCF-) This group provides further control over the calculation of the energy (Hamiltonian) matrix. CUTOFF = Cutoff criterion for the energy matrix. (default=1.0E-8) NWORD = not used. ==========================================================
generated on 7/7/2017