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[会议论文] 作者:Qiquan Luo,Wenhua Zhang,Cen-Feng Fu,Jinlong Yang, 来源:2016年理论与高性能计算化学国际会议(International Conference on Theoretical 年份:2016
  A single Pd atom embedded in mono-and divacancy on graphene(Pd1m-G vs.Pd1d-G),as well as a Pd dimer respective embedded in divacancy,trivacancy and quadvaca...
[会议论文] 作者:Cen-Feng Fu,Qiquan Luo,Xingxing Li,Jinlong Yang, 来源:2016年理论与高性能计算化学国际会议(International Conference on Theoretical 年份:2016
  The Z-scheme mechanism is an efficient route for hydrogen production from photocatalytic water splitting,due to the advantage of preventing the recombinatio...
[会议论文] 作者:Lei Wang,Qiquan Luo,Wenhua Zhang,Jinlong Yang, 来源:第十二届全国量子化学会议 年份:2014
A single atom of non-noble metals(Fe,Co,Ni and Cu)embedded graphene(M-G)has been studied for removing CO in hydrogen atmosphere using density functional theory calculations.Fe-G and Co-G can capture u...
[期刊论文] 作者:Liang Liang,Peiquan Ling,Yuhuan Li,Li Li,Jiandang Liu,Qiquan Luo,Hongjun Zhang,Qian Xu,Yang Pan,Junfa, 来源:中国科学:化学英文版 年份:2021
To realize efficient atmospheric CO2 chemisorption and activation,abundant Ti3+ sites and oxygen vacancies in TiO2 ultrathin layers were designed.Positron annihilation lifetime spectroscopy and theoretical calculations fir...
[期刊论文] 作者:Liang Liang,Peiquan Ling,Yuhuan Li,Li Li,Jiandang Liu,Qiquan Luo,Hongjun Zhang,Qian Xu,Yang Pan,Junfa, 来源:中国科学:化学(英文版) 年份:2021
To realize efficient atmospheric CO2 chemisorption and activation,abundant Ti3+ sites and oxygen vacancies in TiO2 ultrathin layers were designed.Positron annihilation lifetime spectroscopy and theoretical calculations first unveil each oxy......
[期刊论文] 作者:Liu,Tao Ding,Beibei Pang,Lan Wang,Xiaokang Liu,Xinyi Shen,Sicong Wang,Dan Wu,Dong Liu,Linlin Cao,Qiquan Luo, 来源:纳微快报(英文版) 年份:2021
Surface chemistry modification represents a promising strategy to tailor the adsorption and activation of reaction intermediates for enhancing activity. Herein, we designed a surface oxygen-injection strategy to tune the electronic structur......
[期刊论文] 作者:Liu,Tao Ding,Beibei Pang,Lan Wang,Xiaokang Liu,Xinyi Shen,Sicong Wang,Dan Wu,Dong Liu,Linlin Cao,Qiquan Luo, 来源:纳微快报:英文版 年份:2021
Surface chemistry modification represents a promising strategy to tailor the adsorption and activation of reaction intermediates for enhancing activity.Herein,we designed a surface oxygen-injection strategy to tune the electronic structure ......
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