NWChem-C

10 commits 2 branches 0 tags 626 KiB

Author	SHA1	Message	Date
Adam Parler	efd354baf1	Began work on 'gradients' library	2023-12-06 02:53:51 -08:00
Adam Parler	8663962fcf	Moved from C++ to C. Updated Python files.	2026-05-28 13:06:31 -04:00
Adam Parler	02608cf25a	Added some scf files	2023-11-29 23:29:08 -08:00
Adam Parler	b08f9320db	Merge branch 'adams-apple' of gitlab:aparler/nwchem-convert into main	2023-07-09 13:35:16 -07:00
Adam Parler	f6c3a71f6d	Added data files	2026-05-28 01:25:39 -04:00
Adam Parler	d611aff543	Added .gitignore file	2026-05-28 01:22:50 -04:00
Adam Parler	56ec4c5abe	add README	2022-11-01 13:30:14 -07:00
Adam Parler	7f973deb20	Merge pull request #1 from bigperm17/development Added a few files to begin translating	2021-10-03 11:50:01 -07:00
Adam Parler	7e8da872a1	Added a few files to begin translating	2026-05-28 00:27:02 -04:00
Adam Parler	c0f6f4d1c4	Initial commit	2021-10-03 11:44:57 -07:00