Skip to content

Pull requests: MRChemSoft/mrchem

New pull request New
11 Open 411 Closed
11 Open 411 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

Print norm(grad E) WIP Work in progress
#543 opened Feb 3, 2026 by edinvay • Draft
Use only LDA exchange in SAD guess instead of SVWN5.
#542 opened Feb 2, 2026 by susilehtola Loading…
1
KAIN for complex orbitals
#540 opened Jan 20, 2026 by edinvay Loading…
3
Grad(E) WIP Work in progress
#537 opened Jan 9, 2026 by edinvay • Draft
1
Update to SAD routines and data
#535 opened Dec 21, 2025 by susilehtola Loading…
3
Implement external magnetic field operator
#534 opened Dec 19, 2025 by moorberry • Draft
Population analysis feature
#525 opened Dec 2, 2025 by msnik1999 • Draft
5
Adding Libxc support feature
#521 opened Nov 5, 2025 by Tirtho13 Loading…
10 of 13 tasks
1
@ylvao @Tirtho13
81
WIP: Mrchem+DMRG
#518 opened Oct 29, 2025 by martinanibbi • Draft
2
Pseudopotentials and numeric orbitals for initial guess
#502 opened Feb 21, 2025 by moritzgubler Loading…
35
Excited states solver WIP Work in progress
#437 opened Nov 10, 2022 by Gabrielgerez • Draft
4 of 7 tasks
2
ProTip! Mix and match filters to narrow down what you’re looking for.