Skip to content

Pull requests: ReactionMechanismGenerator/RMG-database

New pull request New
50 Open 500 Closed
50 Open 500 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

Added recommended_libraries.yml
#712 opened Mar 27, 2026 by alongd Loading…
7
Forbid trioxidanyl [O]OO which creates singlet O2
#711 opened Mar 24, 2026 by sevyharris Loading…
4
Pt111 MLIP-delta Reactions
#707 opened Mar 4, 2026 by mjohnson541 Loading…
Fix discontinuity in formic acid
#704 opened Dec 19, 2025 by sevyharris Loading…
1
2
New PFAS thermal decomposition families
#702 opened Oct 21, 2025 by Nora-Khalil Loading…
1
Added thermo library for sulfur.
#700 opened Sep 10, 2025 by EstyRitov Loading…
@EstyRitov
2
Selective Solvation Corrections
#695 opened Jul 1, 2025 by ssun30 • Draft
1
Removed H2 + O2 + O2 form primaryH2O2
#692 opened Jun 19, 2025 by alongd Loading…
2
updated XOH NASA7 polynomials
#690 opened May 1, 2025 by kirkbadger18 Loading…
2
Added kinetics "CH3OH+H=CH3+H2O"
#686 opened Mar 25, 2025 by jeehyuny Loading…
3
Jetfuels thermo library
#685 opened Feb 26, 2025 by MichalKesl Loading…
Add thermo and kinetics data for electrocatalytic CO2 reduction Status: WIP
#677 opened Jan 23, 2025 by ssun30 • Draft
@ssun30
1
Update thermo
#672 opened Dec 10, 2024 by 12Chao Loading…
2
Require birad_r_recombination to be between a doublet and triplet
#662 opened Aug 15, 2024 by donerancl • Draft
9
Corrected CH2 & CH2* species for reactions in JetSurF2.0
#650 opened May 21, 2024 by PoojaNem Loading…
1
2
Adding Fluoromethane chemistry to RMG kinetic database
#624 opened Jun 15, 2023 by SiddhaSharma Loading…
9
Add AEC/BAC for dlpno-ccsd(t)/def2svp//wb97xd/def2svp
#606 opened Feb 5, 2023 by oscarwumit • Draft
1
Lithium
#605 opened Jan 10, 2023 by mjohnson541 Loading…
8
Added BACs data from PR #421
#603 opened Jan 2, 2023 by alongd Loading…
4
Disprop ATG Topic: Tree Gen
#593 opened Sep 8, 2022 by kspieks Loading…
@kspieks
ATG R Addition MultipleBond
#585 opened May 19, 2022 by kspieks Loading…
@kspieks
4
ATG for Intra RH Add Endocyclic family Topic: Kinetics
#578 opened Apr 26, 2022 by kspieks Loading…
@kspieks
Adding halogens to default families
#562 opened Jan 17, 2022 by davidfarinajr Loading…
Halogen kinetics update
#549 opened Nov 20, 2021 by davidfarinajr Loading…
4
Generated tree for Birad_R_Recombination
#519 opened Aug 23, 2021 by sevyharris Loading…
1
ProTip! Exclude everything labeled bug with -label:bug.