1. A DFT Exploration of Efficient Catalysts Based on Metal‐Salen Monomers for the Cycloaddition Reaction of CO2 to Propylene Oxide. Issue 16 (6th June 2017) Authors: Wu, Tao; Wang, Tingting; Sun, Lei; Deng, Kaiming; Deng, Weiqiao; Lu, Ruifeng Journal: ChemistrySelect Issue: Volume 2:Issue 16(2017) Page Start: 4533 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. A theoretical study on the structural and physical properties of the ground-state CaC. (February 2015) Authors: Qian, Yan; Wu, Haiping; Kan, Erjun; Lu, Ruifeng; Tan, Weishi; Deng, Kaiming Journal: Solid state communications Issue: Volume 203(2015) Page Start: 10 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Atomically thin mononitrides SiN and GeN: New two-dimensional wide band gap semiconductors. (27th June 2018) Authors: Qian, Yan; Du, Zhengwei; Zhu, Renzhu; Wu, Haiping; Kan, Erjun; Deng, Kaiming Journal: Europhysics letters Issue: Volume 122:Number 4(2018:May) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Colloidal synthesis of Y-doped SnO2 nanocrystals for efficient and slight hysteresis planar perovskite solar cells. (June 2019) Authors: Song, Jing; Zhang, Weina; Wang, Deng; Deng, Kaiming; Wu, Jihuai; Lan, Zhang Journal: Solar energy Issue: Volume 185(2019) Page Start: 508 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Confinement boosts CO oxidation on an Ni atom embedded inside boron nitride nanotubes. Issue 26 (22nd May 2018) Authors: Zhang, Yadong; Liu, Yuzhen; Meng, Zhaoshun; Ning, Cai; Xiao, Chuanyun; Deng, Kaiming; Jena, Purusottam; Lu, Ruifeng Journal: Physical chemistry chemical physics Issue: Volume 20:Issue 26(2018) Page Start: 17599 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Designing half-metallic ferromagnetism by a new strategy: an example of superhalogen modified graphitic C3N4. Issue 7 (31st January 2018) Authors: Yao, Qiushi; Lu, Min; Du, Yongping; Wu, Fang; Deng, Kaiming; Kan, Erjun Journal: Journal of materials chemistry Issue: Volume 6:Issue 7(2018) Page Start: 1709 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Diverse carrier mobility of monolayer BNCx: a combined density functional theory and Boltzmann transport theory study. (20th October 2017) Authors: Wu, Tao; Deng, Kaiming; Deng, Weiqiao; Lu, Ruifeng Journal: Journal of physics Issue: Volume 29:Number 45(2017) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Dual interfacial modification engineering with p-type NiO nanocrystals for preparing efficient planar perovskite solar cells. Issue 47 (23rd November 2018) Authors: Zhang, Weina; Song, Jing; Wang, Deng; Deng, Kaiming; Wu, Jihuai; Zhang, Lan Journal: Journal of materials chemistry Issue: Volume 6:Issue 47(2018) Page Start: 13034 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Efficient band structure tuning, charge separation, and visible-light response in ZrS2-based van der Waals heterostructures. Issue 3 (22nd December 2015) Authors: Zhang, Xirui; Meng, Zhaoshun; Rao, Dewei; Wang, Yunhui; Shi, Qi; Liu, Yuzhen; Wu, Haiping; Deng, Kaiming; Liu, Hongyang; Lu, Ruifeng Journal: Energy & environmental science Issue: Volume 9:Issue 3(2016) Page Start: 841 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. Electronic and magnetic properties of an AlN monolayer doped with first-row elements: a first-principles study. Issue 24 (15th March 2015) Authors: Bai, Yujie; Deng, Kaiming; Kan, Erjun Journal: RSC advances Issue: Volume 5:Issue 24(2015) Page Start: 18352 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗