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#atomistic-simulations (7 Repositories)
Ranked open-source repositories tagged with #atomistic-simulations, scored by pull request acceptance likelihood and maintainer engagement velocity.
Topic Avg Merge Rate
46.3%
Avg Review Latency
8.9h
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7 repositories tagged #atomistic-simulations
A TierPython 157
autoatml/autoplex
Code for automated fitting of machine learned interatomic potentials.
71.4%
Merge Rate
24h
First Review
67%
1st-Timers
3
Maintainers
B TierFOFortran 437
dftbplus/dftbplus
DFTB+ general package for performing fast atomistic simulations
52.9%
Merge Rate
1d
First Review
100%
1st-Timers
3
Maintainers
B TierPython 969
mir-group/nequip
NequIP is a code for building E(3)-equivariant interatomic potentials
100.0%
Merge Rate
9h
First Review
100%
1st-Timers
1
Maintainers
B TierFOFortran 850
grimme-lab/xtb
Semiempirical Extended Tight-Binding Program Package
100.0%
Merge Rate
4h
First Review
0%
1st-Timers
1
Maintainers
B TierFOFortran 351
crest-lab/crest
CREST - A program for the automated exploration of low-energy molecular chemical space.
0.0%
Merge Rate
-
First Review
0%
1st-Timers
0
Maintainers
D TierPython 499
mir-group/allegro
Allegro is a code for building highly scalable E(3)-equivariant interatomic potentials
0.0%
Merge Rate
-
First Review
0%
1st-Timers
0
Maintainers
D TierFOFortran 258
pierrehirel/atomsk
Atomsk: A Tool For Manipulating And Converting Atomic Data Files -
0.0%
Merge Rate
-
First Review
0%
1st-Timers
0
Maintainers