Steven E. Wheeler
Results
2
issues of
Steven E. Wheeler
For ORCA inputs using "Gaussian's B3LYP", automatically include "NoCosx" keyword to more closely match Gaussian results (ORCA uses RIJCOSX by default). Similarly, add option to do "ORCA's 6-31G*" that requests...
enhancement
The recent fix to glob_files made it so none of the CLS could read from STDIN. I made a small change to glob_files that fixes many cases. However, many CLS...