collaborators

1 paper

cond-mat.mtrl-sci2024

Data-driven prediction of structure of metal-organic frameworks

Elizaveta Yakovenko, Iurii Nevolin, Anatoliy Chasovskikh +2

Crystal structure prediction (CSP) has proven to be a highly effective route for discovering new materials. Substantial advancements have been made in CSP of inorganic and molecula…