1. Electronic Structures of S/C-Doped TiO2 Anatase (101) Surface: First-Principles Calculations. (2nd June 2014) Authors: Chen, Qili; Liu, Min; He, Kaihua; Li, Bo Other Names: Yu Jiaguo Academic Editor. Journal: International journal of photoenergy Issue: Volume 2014(2014) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. First principles study of the Mn-doping effect on the physical and chemical properties of mullite-family Al2SiO5. Issue 36 (6th September 2017) Authors: Wang, Qingbo; Liang, Chaoping; Zheng, Yongping; Ashburn, Nickolas; Oh, Young Jun; Kong, Fantai; Zhang, Chenxi; Nie, Yifan; Sun, Jian; He, Kaihua; Ye, Yu; Chen, Rong; Shan, Bin; Cho, Kyeongjae Journal: Physical chemistry chemical physics Issue: Volume 19:Issue 36(2017) Page Start: 24991 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Geometric and electronic diversity of metal doped boron clusters. (7th March 2023) Authors: Chen, Bole; He, Kaihua; Dai, Wei; Gutsev, Gennady L; Lu, Cheng Journal: Journal of physics Issue: Volume 35:Number 18(2023) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. The effect of the Zn/Sn ratio on the formation of single phase kesterite Cu2ZnSnS4 solar cell material. Issue 11 (1st August 2017) Authors: Sun, Jian; Hu, Yue; Liao, Ke; Tang, Chunhua; Lang, Yun; Xu, Jianmei; Zhao, Ling; Zhou, Wei; Wang, Qing; He, Kaihua Journal: Ceramics international Issue: Volume 43:Issue 11(2017) Page Start: 8103 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Theoretical investigations on the structural stability, structural and physical properties, and bonding feature for RuX (X = Si, Ge, Sn) with B20 and B2 phases. (September 2020) Authors: Zhang, Chuanzhao; Jin, Yuanyuan; Kong, Panlong; Li, Song; Chen, Shanjun; Zhang, Weibin; Cheng, Shubo; He, Kaihua; Dai, Wei Journal: Materials today communications Issue: Volume 24(2020) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗