Single-atom alloy catalysts designed by first-principles calculations and artificial intelligence

por Han, Zhong-Kang, Sarker, Debalaya, Ouyang, Runhai, Mazheika, Aliaksei, Gao, Yi, Levchenko, Sergey V.
Publicado 2021

Prediction and Classification of Formation Energies of Binary Compounds by Machine Learning: An Approach without Crystal Structure Information

por Mao, Yuanqing, Yang, Hongliang, Sheng, Ye, Wang, Jiping, Ouyang, Runhai, Ye, Caichao, Yang, Jiong, Zhang, Wenqing
Publicado 2021

New tolerance factor to predict the stability of perovskite oxides and halides

por Bartel, Christopher J., Sutton, Christopher, Goldsmith, Bryan R., Ouyang, Runhai, Musgrave, Charles B., Ghiringhelli, Luca M., Scheffler, Matthias
Publicado 2019

Architecture Design and Catalytic Activity: Non‐Noble Bimetallic CoFe/fe(3)O(4) Core–Shell Structures for CO(2) Hydrogenation

por Miao, Wenkang, Hao, Ronghui, Wang, Jingzhou, Wang, Zihan, Lin, Wenxin, Liu, Heguang, Feng, Zhenjie, Lyu, Yingchun, Li, Qianqian, Jia, Dongling, Ouyang, Runhai, Cheng, Jipeng, Nie, Anmin, Wu, Jinsong
Publicado 2022