chgnet

Pretrained Universal Neural Network Potential for Charge-informed Atomistic Modeling

Installation

In a virtualenv (see these instructions if you need to create one):

pip3 install chgnet

Releases

Version Released Bullseye
Python 3.9
Bookworm
Python 3.11
Files
0.4.0 2024-09-16    
0.3.8 2024-06-05    
0.3.7 yanked 2024-06-01    
0.3.5 2024-03-12    
0.3.4 2024-02-08    
0.3.3 2023-12-08    
0.3.2 2023-11-19    
0.3.1 2023-10-23    
0.3.0 yanked 2023-10-23    
0.2.2 2023-10-12    
0.2.1 2023-09-19    
0.2.0 yanked 2023-07-22  
0.1.4 2023-06-24  
0.1.3 2023-05-06  
0.1.2 2023-05-05  

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Page last updated 2024-09-17 00:10:50 UTC