Research Research groups Member of: Computational Systems Chemistry Publications 2 publications Page 1 of 1 Machine learned potentials by active learning from organic crystal structure prediction landscapes Patrick Walter Villers Butler, Roohollah Hafizi, & Graeme M. Day , 2024 , Journal of Physical Chemistry A Type: article Multi-fidelity statistical machine learning for molecular crystal structure prediction Olga Egorova, Roohollah Hafizi, David Woods, & Graeme M. Day , 2020 , Journal of Physical Chemistry A , 124 (39) , 8065--8078 DOI: 10.1021/acs.jpca.0c05006 Type: article