Evaluation and comparison of classical interatomic potentials through a user-friendly interactive web-interface

por Choudhary, Kamal, Congo, Faical Yannick P., Liang, Tao, Becker, Chandler, Hennig, Richard G., Tavazza, Francesca
Publicado 2017

Computational screening of high-performance optoelectronic materials using OptB88vdW and TB-mBJ formalisms

por Choudhary, Kamal, Zhang, Qin, Reid, Andrew C.E., Chowdhury, Sugata, Van Nguyen, Nhan, Trautt, Zachary, Newrock, Marcus W., Congo, Faical Yannick, Tavazza, Francesca
Publicado 2018