甲烷在金属表面解离吸附的动力学研究

21873086
2018
B0304.化学动力学
沈祥建
面上项目
副教授
郑州大学
65万元
解离吸附;势能面;多原子分子反应;量子动力学;准经典动力学
2019-01-01到2022-12-31
  • 中英文摘要
  • 结题摘要
  • 结题报告
  • 项目成果
  • 项目参与人
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序号 标题 类型 作者
1 Enhanced diffusion and permeation of hydrogen species on the partially carbon covered iron surfaces 期刊论文 Yuanjie Li;Feina Zhai;Ziyu Xiao;Xin Zhang;Xiangjian Shen
2 NiCoP nanowire@NiCo-layered double hydroxides nanosheet heterostructure for flexible asymmetric supercapacitors 期刊论文 Xiangyang Gao;Yafei Zhao;Kaiqing Dai;Jingtao Wang;Bing Zhang;Xiangjian Shen
3 Enhanced effect of H2O monolayer on metal doped nitrogen-containing graphene for hydrogen evolution reactions 期刊论文 Xiaojing Liu;Xiangjian Shen
4 A Simulated-TPD Study of H2 Desorption on Metal Surfaces 期刊论文 Shuangshuang Lv;Xiaojing Liu;Xiangjian Shen
5 Hydrogen Evolution Reaction on Transition Metal Nanoparticles from First-principles 期刊论文 Jiake Cui;Xiaojing Liu;Yifeng Wang;Dandan Song;Yugang Ren;Xiangjian Shen
6 Hydrogen diffusion on and into the hydrogen-covered Pd(1 0 0) surfaces from fist-principles 期刊论文 Dandan Song;Xiaojing Liu;Xiangjian Shen
7 Engineering the Activity and Stability of MOF-Nanocomposites for Effient Water Oxidation 期刊论文 Yuan Wang;Borui Liu;Xiangjian Shen;Hamidreza Arandiyan;Tingwen Zhao;Yibing Li;Magnus Garbrecht;Zhen Su;Li Han;Antonio Tricoli;Chuan Zhao
8 Tuning the surface energy density of non-stoichiometric LaCoO3 perovskite for enhanced water oxidation 期刊论文 Yuan Wang;Xiangjian Shen;Hamidreza Arandiyan;Yanting Yin;Fanfei Sun;Xianjue Chen;Magnus Garbrecht;Li Han;Gunther G. Andersson;Chuan Zhao
9 Diffusion mechanisms of metal atoms in Pd-Au bimetallic catalyst under CO atmosphere based on ab initio molecular dynamics 期刊论文 Yongpeng Yang;Xiangjian Shen;Yi-Fan Han
10 Hot-Atom Mechanism in Syngas Methanation on Precovered Pd(100) Surfaces 期刊论文 Dandan Song;Yuanjie Li;Xiaojing Liu;Zhaojun Zhang;Xiangjian Shen
11 A thermodynamics study of hydrogen interaction with (110) transition metal surfaces 期刊论文 Feina Zhai;Yun Tian;Dandan Song;Yuanjie Li;Xiaojing Liu;Ting Li;Zhaojun Zhang;Xiangjian Shen
12 Dissociative Chemisorption of O2 on Agn and Agn-1Ir (n=3-26) Clusters: A First-principle Study 期刊论文 Chuangchuang Wang;Yongpeng Yang;Xiaojing Liu;Yuanjie Li;Dandan Song;Yun Tian;Zhaojun Zhang;Xiangjian Shen
13 Theoretical new insights into hydrogen interaction with single-atom Zn- and co-doped copper metal catalysts 期刊论文 Yuanjie Li;Xiaojing Liu;Ling Li;Zhaojun Zhang;Xiangjian Shen
14 Abnormal subsurface hydrogen diffusion behaviors in heterogeneous hydrogenation reactions 期刊论文 Feina Zhai;Yuanjie Li;Yongpeng Yang;Sisi Jiang;Xiangjian Shen
15 In Situ Reconstruction of V-Doped Ni2P Pre-Catalysts with Tunable Electronic Structures for Water Oxidation 期刊论文 Tingwen Zhao;Xiangjian Shen;Yuan Wang;Rosalie K. Hocking;Yibing Li;Chengli Rong;Kamran Dastafkan;Zhen Su;Chuan Zhao
16 Methane activation on single-atom Ir-doped metal nanoparticles from first principles 期刊论文 Yugang Ren;Xiaojing Liu;Zhaojun Zhang;Xiangjian Shen
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