CH$_4$ and CO$_2$ Adsorption Mechanisms on Monolayer Graphenylene and their Effects on Optical and Electronic Properties

Autor: Aligayev, A., Dominguez-Gutierrez, F. J., Chourashiya, M., Papanikolaou, S., Huang, Q.

In this study, we employ a computational chemistry-based modeling approach to investigate the adsorption mechanisms of CH$_4$ and CO$_2$ on monolayer GPNL, with a specific focus on their effects on optical adsorption and electrical transport properti

Externí odkaz: http://arxiv.org/abs/2307.13472

Computational modeling of CH4 and CO2 adsorption on monolayer graphenylene: Implications for optoelectronic properties and hydrogen production

Autor: Aligayev, A., Dominguez-Gutierrez, F.J., Chourashiya, M., Papanikolaou, S., Huang, Qing

Publikováno v: In Diamond & Related Materials August 2024 147

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Novel Single Perovskite Material for Visible-Light Photocatalytic CO 2 Reduction via Joint Experimental and DFT Study.

Autor: Samadova U; University of Electronic Science and Technology of China, Chengdu, 05-400, P. R. China.; Institute of Physics Ministry of Science and Education Republic of Azerbaijan, H.Javid 131, Baku, AZ-1143, Azerbaijan., Aligayev A; Science Island Branch of Graduate School, University of Science and Technology of China, Hefei, 230026, P. R. China.; NOMATEN Centre of Excellence, National Center for Nuclear Research, 05-400 Swierk/Otwock, Otwock, Poland., Ismail PM; University of Electronic Science and Technology of China, Chengdu, 05-400, P. R. China., Liu M; SEU-FEI Nano-Pico Center, Key Laboratory of MEMS of Ministry of Education, School of Integrated Circuits, Southeast University, Nanjing, 210096, P. R. China., Safarzade U; Institute of Physics Ministry of Science and Education Republic of Azerbaijan, H.Javid 131, Baku, AZ-1143, Azerbaijan., Hashimov A; Institute of Physics Ministry of Science and Education Republic of Azerbaijan, H.Javid 131, Baku, AZ-1143, Azerbaijan., Zakiyeva I; Institute of Physics Ministry of Science and Education Republic of Azerbaijan, H.Javid 131, Baku, AZ-1143, Azerbaijan., Rabbani SS; University of Electronic Science and Technology of China, Chengdu, 05-400, P. R. China., Khan H; University of Electronic Science and Technology of China, Chengdu, 05-400, P. R. China., Huang Q; Science Island Branch of Graduate School, University of Science and Technology of China, Hefei, 230026, P. R. China., Wu X; School of Mechanical Engineering, Chengdu University, Chengdu, 610106, P. R. China., Zhong L; SEU-FEI Nano-Pico Center, Key Laboratory of MEMS of Ministry of Education, School of Integrated Circuits, Southeast University, Nanjing, 210096, P. R. China., Raziq F; Institute for Advanced Study, Chengdu University, Chengdu, 610106, P. R. China., Yi J; Global Innovative Centre for Advanced Nanomaterials, School of Engineering, The University of Newcastle, Callaghan, NSW, 2308, Australia., Xia P; Yangtze Delta Region Institute (Huzhou) University of Electronic Science and Technology, Huzhou, 313001, P. R. China., Qiao L; University of Electronic Science and Technology of China, Chengdu, 05-400, P. R. China.

Publikováno v: Small (Weinheim an der Bergstrasse, Germany) [Small] 2024 Nov 20, pp. e2407206. Date of Electronic Publication: 2024 Nov 20.

Exceptional Photocatalytic Activities of rGO Modified (B,N) Co‐Doped WO3, Coupled with CdSe QDs for One Photon Z‐Scheme System: A Joint Experimental and DFT Study.

Autor: Raziq, Fazal^1,2 (AUTHOR), Aligayev, Amil² (AUTHOR), Shen, Huahai³ (AUTHOR), Ali, Sharafat^1,2 (AUTHOR), Shah, Rahim² (AUTHOR), Ali, Sajjad⁴ (AUTHOR), Bakhtiar, Syedul H.⁵ (AUTHOR), Ali, Asad⁶ (AUTHOR), Zarshad, Naghat⁶ (AUTHOR), Zada, Amir⁶ (AUTHOR), Xia, Xiang² (AUTHOR), Zu, Xiaotao² (AUTHOR), Khan, Muslim⁷ (AUTHOR), Wu, Xiaoqiang⁸ (AUTHOR), Kong, Qingquan⁸ (AUTHOR), Liu, Chunming² (AUTHOR) cmliu@uestc.edu.cn, Qiao, Liang^1,2 (AUTHOR) liang.qiao@uestc.edu.cn

Publikováno v: Advanced Science. 1/14/2022, Vol. 9 Issue 2, p1-10. 10p.