Skip to content

Pull requests: theochem/ffprime

New pull request New
8 Open 0 Closed
8 Open 0 Closed
Author
Filter by author
Loading
Label
Filter by label
Loading
Use alt + click/return to exclude labels
or ⇧ + click/return for logical OR
Projects
Filter by project
Loading
Milestones
Filter by milestone
Loading
Reviews
Filter by reviews
No reviews Review required Approved review Changes requested
Assignee
Filter by who’s assigned
Assigned to nobody Loading
Sort
Sort by
Newest Oldest Most commented Least commented Recently updated Least recently updated Best match
Most reactions
👍 👎 😄 🎉 😕 ❤️ 🚀 👀

Pull requests list

Add Cartesian <-> spherical multipole conversion utilities
#11 opened Mar 28, 2026 by harshjha15335 Loading…
1
Fix AttributeError when Hessian has no negative eigenvalues
#10 opened Mar 17, 2026 by WHOIM1205 Loading…
1
Fix missing negative sign in Grimme D1/D2 dispersion energy
#9 opened Mar 17, 2026 by WHOIM1205 Loading…
1
Fix critical bugs and enhance security
#8 opened Mar 15, 2026 by Eashan-H Loading…
Refactor angle force constant formula and add test suite
#7 opened Mar 11, 2026 by Eashan-H Loading…
Add dipole and quadrupole electrostatic potential and field with unit test
#5 opened Mar 9, 2026 by harshjha15335 Loading…
Add dipole electrostatic potential and field functions
#4 opened Mar 8, 2026 by rahulbalaji13 Loading…
1
Add monopole electrostatic potential and field with unit tests
#2 opened Feb 20, 2026 by chinmaybhardwaj711 Loading…
2
ProTip! What’s not been updated in a month: updated:<2026-03-18.