aimnet2calc
AIMNet2 Calculator: Fast, Accurate Molecular Simulations
AIMNet2 Calculator: Fast, Accurate Molecular Simulations
To install this package, run one of the following:
This package integrates the powerful AIMNet2 neural network potential into your simulation workflows. AIMNet2 provides fast and reliable energy, force, and property calculations for molecules containing a diverse range of elements.
Summary
AIMNet2 Calculator: Fast, Accurate Molecular Simulations
Information Last Updated
Mar 25, 2025 at 16:26
License
MIT
Total Downloads
15
Platforms
GitHub Repository
https://github.com/zubatyuk/aimnet2calcDocumentation
https://github.com/zubatyuk/aimnet2calc