Giters
isayevlab
/
AIMNet2
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Stargazers:
63
Watchers:
8
Issues:
19
Forks:
18
isayevlab/AIMNet2 Issues
Hessian computation fails
Closed
21 days ago
Comments count
14
D3 correction not applied
Closed
21 days ago
Comments count
8
RuntimeError - sparse_nb is empty
Closed
21 days ago
Comments count
5
GPU Memory Problem
Closed
a month ago
Comments count
6
Fine tuning AIMNet2
Updated
2 months ago
RuntimeError when using new AIMNet2ASE calculator
Updated
2 months ago
Apple Silicon/ARM build
Closed
5 months ago
Comments count
1
Conda package
Updated
5 months ago
Comments count
5
Energy Unit
Closed
5 months ago
netrork > network
Closed
6 months ago
Comments count
1
Struggling With Autograd
Closed
7 months ago
Comments count
3
Periodic Systems
Updated
7 months ago
Comments count
2
Questions about extending AIMnet2 to dimers or large molecules
Closed
7 months ago
Comments count
2
Malformatted traj.xyz
Closed
8 months ago
Comments count
2
Docker build error
Updated
9 months ago
Comments count
1
MD calculations explode
Closed
9 months ago
Comments count
2
Dockerfile and requirements.txt for reproducibility
Closed
10 months ago
Comments count
2
Error loading the model on CPU
Closed
10 months ago
Comments count
2
License
Closed
10 months ago
Comments count
1