In this repo, we have used e3nn code to predict binding energy of surface(sd_e3nn.py) and adsorbed data (ad_e3nn.py). The details about installing e3nn is explained inside the Binding_energy_prediction folder.
-
Notifications
You must be signed in to change notification settings - Fork 0
SourinDeyUW/beast_thrust3
Folders and files
Name | Name | Last commit message | Last commit date | |
---|---|---|---|---|
Repository files navigation
About
No description, website, or topics provided.
Resources
Stars
Watchers
Forks
Releases
No releases published
Packages 0
No packages published