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Testing the parallel binaries

The binaries ridft, rdgrad, dscf, grad, and ricc2 can be tested by the usual test suite: go to $TURBODIR/TURBOTEST and call TTEST

Note: Some of the tests are very small and will only pass properly if 2 CPUs are used at maximum. Therefore TTEST will not run any test if $PARNODES is set to a higher value than 2.

If you want to run some of the larger tests with more CPUs, you have to edit the DEFCRIT file in TURBOMOLE/TURBOTEST and change the $defmaxnodes option.



TURBOMOLE