Quan De Wang

Click:

The Last Update Time:..

Current position: Home > Scientific Research > Paper Publications

Paper Publications

Benchmark calculations for bond dissociation energies and enthalpy of formation of chlorinated and brominated polycyclic aromatic hydrocarbons
Release time:2023-08-25  Hits:

DOI number:10.1039/d1ra05391d
Affiliation of Author(s):碳中和研究院
Funded by:其他课题
First Author:Xu, Shenying
Co-author:Quan De Wang,Sun, Mao-Mao,Yin, Guoliang,Liang, Jinhu
Indexed by:Journal paper
Document Code:5b5bb2947c9800b1017c9b1f87d20276
Volume:卷: 11期: 47页: 29690-29701
Translation or Not:no
Date of Publication:2021-09-14

Pre One:Effectively improving the accuracy of PBE functional in calculating the solid band gap via machine learning

Next One:Machine learning prediction of stability, topological properties and band gap of topological insulators in tetradymites

Address:No1,Daxue Road,Xuzhou,Jiangsu,221116,P.R.China    Email: master@cumt.edu.cn
All Rights Reserved by China University of Mining and Technology