Edgar Solomonik
Results
3
issues of
Edgar Solomonik
It would be convenient and would save many cpu hours to have unit benchmarks for integrals, SCF, and CCSD/T/Q.
enhancement
Memory usage spikes during calculation of aomoints, outside of CTF write calls (which are now buffered based on available memory). From my email on 2.10.2015, When running w15-cc-pVDZ on 384...
does not correspond to previous measurements