Bayesian-Driven First-Principles Calculations for Accelerating Exploration of Fast Ion Conductors for Rechargeable Battery Application

por Jalem, Randy, Kanamori, Kenta, Takeuchi, Ichiro, Nakayama, Masanobu, Yamasaki, Hisatsugu, Saito, Toshiya
Publicado 2018

A general representation scheme for crystalline solids based on Voronoi-tessellation real feature values and atomic property data

por Jalem, Randy, Nakayama, Masanobu, Noda, Yusuke, Le, Tam, Takeuchi, Ichiro, Tateyama, Yoshitaka, Yamazaki, Hisatsugu
Publicado 2018