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Single Au atom supported defect mediated boron nitride monolayer as an efficient catalyst for acetylene hydrochlorination: A first principles study 期刊论文
MOLECULAR CATALYSIS, 2021, 卷号: 511, 页码: 9
作者:  Ali, Sajjad;  Haneef, Muhammad;  Akbar, Jehan;  Ullah, Izaz;  Ullah, Sami
收藏  |  浏览/下载:26/0  |  提交时间:2021/11/22
Density Functional Theory Study of a Graphdiyne-Supported Single Au Atom Catalyst for Highly Efficient Acetylene Hydrochlorination 期刊论文
ACS APPLIED NANO MATERIALS, 2021, 卷号: 4, 期号: 6, 页码: 6152-6159
作者:  Ali, Sajjad;  Lian, Zan;  Li, Bo
收藏  |  浏览/下载:52/0  |  提交时间:2021/10/15
The catalytic performance of metal-free defected carbon catalyst towards acetylene hydrochlorination revealed from first-principles calculation 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2020, 页码: 8
作者:  Ali, Sajjad;  Khan, Muhammad Baber Azam;  Khan, Said Alam;  Noora
收藏  |  浏览/下载:26/0  |  提交时间:2021/02/02
Progress and Challenges of Mercury-Free Catalysis for Acetylene Hydrochlorination 期刊论文
CATALYSTS, 2020, 卷号: 10, 期号: 10, 页码: 1-29
作者:  Liu, YX (Liu, Yanxia)[ 1,2,3 ];  Zhao, L (Zhao, Lin)[ 1 ];  Zhang, YG (Zhang, Yagang)[ 1,2,3 ];  Zhang, LT (Zhang, Letao)[ 3 ];  Zan, XJ (Zan, Xingjie)[ 3 ]
收藏  |  浏览/下载:52/0  |  提交时间:2020/12/07
Screening of active center and reactivity descriptor in acetylene hydrochlorination on metal-free doped carbon catalysts from first principle calculations 期刊论文
APPLIED SURFACE SCIENCE, 2019, 卷号: 478, 页码: 574-580
作者:  Ali, Sajjad;  Qiu, YiYang;  Lian, Zan;  Olanrele, Samson;  Lan, GuoJun
收藏  |  浏览/下载:10/0  |  提交时间:2021/02/02
Screening of active center and reactivity descriptor in acetylene hydrochlorination on metal-free doped carbon catalysts from first principle calculations 期刊论文
APPLIED SURFACE SCIENCE, 2019, 卷号: 478, 页码: 574-580
作者:  Ali, Sajjad;  Qiu, YiYang;  Lian, Zan;  Olanrele, Samson;  Lan, GuoJun
收藏  |  浏览/下载:1/0  |  提交时间:2021/02/02
Screening of active center and reactivity descriptor in acetylene hydrochlorination on metal-free doped carbon catalysts from first principle calculations 期刊论文
APPLIED SURFACE SCIENCE, 2019, 卷号: 478, 页码: 574-580
作者:  Ali, Sajjad;  Qiu, YiYang;  Lian, Zan;  Olanrele, Samson;  Lan, GuoJun
收藏  |  浏览/下载:8/0  |  提交时间:2021/02/02
The origin of the extraordinary stability of mercury catalysts on the carbon support: the synergy effects between oxygen groups and defects revealed from a combined experimental and DFT study 期刊论文
CHINESE JOURNAL OF CATALYSIS, 2019, 卷号: 40, 期号: 2, 页码: 141-146
作者:  Li, Jian;  Fan, Jiangtao;  Ali, Sajjad;  Lan, Guojun;  Tang, Haodong
收藏  |  浏览/下载:4/0  |  提交时间:2021/02/02
The origin of the extraordinary stability of mercury catalysts on the carbon support: the synergy effects between oxygen groups and defects revealed from a combined experimental and DFT study 期刊论文
CHINESE JOURNAL OF CATALYSIS, 2019, 卷号: 40, 期号: 2, 页码: 141-146
作者:  Li, Jian;  Fan, Jiangtao;  Ali, Sajjad;  Lan, Guojun;  Tang, Haodong
收藏  |  浏览/下载:2/0  |  提交时间:2021/02/02
The origin of the extraordinary stability of mercury catalysts on the carbon support: the synergy effects between oxygen groups and defects revealed from a combined experimental and DFT study 期刊论文
CHINESE JOURNAL OF CATALYSIS, 2019, 卷号: 40, 期号: 2, 页码: 141-146
作者:  Li, Jian;  Fan, Jiangtao;  Ali, Sajjad;  Lan, Guojun;  Tang, Haodong
收藏  |  浏览/下载:1/0  |  提交时间:2021/02/02


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