atomate2 documentation#
Date: Nov 27, 2023
Useful links: Source Repository | Issues & Ideas | Q&A Support
Atomate2 is an open-source library providing computational workflows for automating first-principles calculations.
Date: Nov 27, 2023
Useful links: Source Repository | Issues & Ideas | Q&A Support
Atomate2 is an open-source library providing computational workflows for automating first-principles calculations.