Skip to content
forked from usnistgov/atomgpt

AtomGPT: Atomistic Generative Pretrained Transformer for Forward and Inverse Materials Design

License

Notifications You must be signed in to change notification settings

wangvei/atomgpt

Folders and files

NameName
Last commit message
Last commit date

Latest commit

 

History

81 Commits
 
 
 
 
 
 
 
 
 
 
 
 
 
 

Repository files navigation

AtomGPT: atomistic generative pre-trained transformer for forward and inverse materials design

Forward model example

python atomgpt/forward_models/forward_models.py --config_name atomgpt/examples/forward_model/config.json

Inverse model example

python atomgpt/inverse_models/inverse_models.py --config_name atomgpt/examples/inverse_model/config.json

#python atomgpt/examples/inverse_model/run.py

(Documentation development is in progress...)

About

AtomGPT: Atomistic Generative Pretrained Transformer for Forward and Inverse Materials Design

Resources

License

Stars

Watchers

Forks

Releases

No releases published

Packages

No packages published

Languages

  • Python 100.0%