Material discovery by combining stochastic surface walking global optimization with a neural network.

Huang, Si-Da; Shang, Cheng; Zhang, Xiao-Jie; Liu, Zhi-Pan.

Afiliação

Huang SD; Collaborative Innovation Center of Chemistry for Energy Material , Key Laboratory of Computational Physical Science (Ministry of Education) , Shanghai Key Laboratory of Molecular Catalysis and Innovative Materials , Department of Chemistry , Fudan University , Shanghai 200433 , China . Email: zpliu@
Shang C; Collaborative Innovation Center of Chemistry for Energy Material , Key Laboratory of Computational Physical Science (Ministry of Education) , Shanghai Key Laboratory of Molecular Catalysis and Innovative Materials , Department of Chemistry , Fudan University , Shanghai 200433 , China . Email: zpliu@
Zhang XJ; Collaborative Innovation Center of Chemistry for Energy Material , Key Laboratory of Computational Physical Science (Ministry of Education) , Shanghai Key Laboratory of Molecular Catalysis and Innovative Materials , Department of Chemistry , Fudan University , Shanghai 200433 , China . Email: zpliu@
Liu ZP; Collaborative Innovation Center of Chemistry for Energy Material , Key Laboratory of Computational Physical Science (Ministry of Education) , Shanghai Key Laboratory of Molecular Catalysis and Innovative Materials , Department of Chemistry , Fudan University , Shanghai 200433 , China . Email: zpliu@

Chem Sci ; 8(9): 6327-6337, 2017 Sep 01.

Article em En | MEDLINE | ID: mdl-29308174

Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2017 Tipo de documento: Article

Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2017 Tipo de documento: Article