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mlip-arena / mlip_arena

Commit History

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

cyrusyc commited on

update model tasks in registry
c31fd29

cyrusyc commited on

update combustion
7c36d54

cyrusyc commited on

add sevennet diatomic json
152939f

cyrusyc commited on

update leaderboard
aecc8a6

cyrusyc commited on

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

cyrusyc commited on

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

add md step bar charts
606b930

cyrusyc commited on

add stability data, update page
0d1ce35

cyrusyc commited on

update ptable, add statbility, update pyproject.toml
3eda6d3

cyrusyc commited on

refactor external calculators; better handle devices
7cbf186

cyrusyc commited on

add task `stability` and md run script
0ffedd3

cyrusyc commited on

reform scaffold
9d1a2a5

cyrusyc commited on

add notebooks
5225959

cyrusyc commited on

add torch to requiremens
d72faca

cyrusyc commited on

add alignn
eadac93

cyrusyc commited on

add alignn
5b01054

cyrusyc commited on

add equiformer, escn; add leaderboard
51cdd18

cyrusyc commited on

add equiformer, escn; add leaderboard
221dfe3

cyrusyc commited on

add mlip diatomic curves
d9ed521

cyrusyc commited on

implement app scaffold, add diatomics visualization
034838c

cyrusyc commited on

implement app scaffold, add diatomics visualization
d7d26c2

cyrusyc commited on

page configurations
056d8d3

cyrusyc commited on

update before hf
0b5acc7

cyrusyc commited on

updates before modification
ee784cf

cyrusyc commited on

test hf hub
2d8bda8

cyrusyc commited on

update local change
5cb0b67

cyrusyc commited on

improve class defintion and new task
49d0cfc

cyrusyc commited on

add jobs tasks
b3722a8

cyrusyc commited on

update
66b89f4

cyrusyc commited on

move serve folder
bfed564

cyrusyc commited on

test streamlit
3173358

cyrusyc commited on

add streamlit metadata
e473a42

cyrusyc commited on