I'm a PhD student in the MolMD group at Stony Brook University looking into how data can be used to expedite materials design and discovery for energy storage applications. For this, I'm also developing new computational tools for predicting and optimizing materials properties.
rashatwi / combat Goto Github PK
View Code? Open in Web Editor NEWThe ComBat Database: A database of quantum-chemical and molecular dynamics properties for Li-S electrolytes.
Home Page: https://rashatwi.github.io/combat/
License: MIT License