mlip-arena / mlip_arena

Commit History

add mrore/update diatomics curves
8b028aa

cyrusyc commited on

clean up
5f29db9

cyrusyc commited on

Improve dependencies (#20)
b22d49d
unverified

Yuan (Cyrus) Chiang commited on

comment out unsupported models from registry
c1d2139

cyrusyc commited on

update wte
fff5e51

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update wte table
831bd2c

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Add ORB v2 (#18)
8396dce
unverified

Yuan (Cyrus) Chiang commited on

add thermal conductivity rank and page (#16)
c19aed5
unverified

Yuan (Cyrus) Chiang commited on

update readme
fdb2bc5

cyrusyc commited on

Feat: add DeepMD pretrain model (#12)
f1eddde
unverified

Anyang Peng cyrusyc commited on

add version tag
aa496c2

cyrusyc commited on

update visual; add captions
22f0dbc

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update version
76e941d

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test md
4817e63

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clearn up unused md; force to use the updated one
dd24ea1

cyrusyc commited on

Add `eqV2_86M_omat_mp_salex` model (#14)
52c1bfb
unverified

Yuan (Cyrus) Chiang commited on

update gitignore
bd8cd88

cyrusyc commited on

add eos notebook
c7922c2

cyrusyc commited on

minor cleanup
5b87ae4

cyrusyc commited on

restrict mace version, update eos test
79e5bd9

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add eos flow file
1e50f35

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add relax task, eos workflow, and prefect test
1effaf5

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clean up and add copyright notice
2f7e23a

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add sevennet stability json
6bc1d71

cyrusyc commited on

add cache for stability page
f7e9143

cyrusyc commited on

fix colormap not updating due to cache
bcf00b7

cyrusyc commited on

remove python3.9 test; update st pages
ba1879f

cyrusyc commited on

longer combustion trajs, add energy change, reaction energy
bd9f7b0

cyrusyc commited on

some minor cleanup and test
dba3031

cyrusyc commited on

Add COM drift for combustion (#10)
d937c80
unverified

Yuan (Cyrus) Chiang commited on

add combustion results; design rank import mechanism
7dfb0b7

cyrusyc commited on

avoid prefect dependency on hf
18cbf00

cyrusyc commited on

add eSCN; refactor app.py
78cdc34

cyrusyc commited on

Add calculator test (#6)
1c7cd6c
unverified

Yuan (Cyrus) Chiang commited on

update external calculator classes; update diatomic curves
cf512f3

cyrusyc commited on

add package and ckpt info
d78049e

cyrusyc commited on

add orb model to diatomic tasks
05e8129

cyrusyc commited on

add release workflow
ad38d4e

cyrusyc commited on

fix typo; add diatomic, combustion notebooks
f0fdb88

cyrusyc commited on

add combustion MD runtime speed
17bfe96

cyrusyc commited on

update model metadata
7f5709e

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update model tasks in registry
c31fd29

cyrusyc commited on

update combustion
7c36d54

cyrusyc commited on

add sevennet diatomic json
152939f

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update leaderboard
aecc8a6

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add warning pre-alpha message, add equiformer-oc20
9361457

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add EquiformerV2 OC20 ckpt
03db5cf

cyrusyc commited on

add m3gnet diatomic task
8a5a7ef

cyrusyc commited on

add combustion page
e6cac5c

cyrusyc commited on

improve stability visualization; update leaderborad
3b3aaa9

cyrusyc commited on