aparler/NWChem-C
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Adam Parler efd354baf1 Began work on 'gradients' library
2023-12-06 02:53:51 -08:00
src Began work on 'gradients' library 2023-12-06 02:53:51 -08:00
.gitignore Moved from C++ to C. Updated Python files. 2026-05-28 13:06:31 -04:00
LICENSE Initial commit 2021-10-03 11:44:57 -07:00
Makefile Began work on 'gradients' library 2023-12-06 02:53:51 -08:00
README.md Initial commit 2021-10-03 11:44:57 -07:00

README.md

nwchem_convert

Converting NWChem code from FORTRAN to C/C++