COMP 104-Density functional theory study of CO oxidation on Pd alloy surfaces

被引:0
作者
Sullivan, Michael B. [1 ]
Zhang, Jia [1 ]
Lim, Freda C. H. [1 ]
Jin, Hong-Mei [1 ]
Wu, Ping [1 ]
机构
[1] Inst High Performance Comp, Singapore 117528, Singapore
来源
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 2008年 / 235卷
关键词
D O I
暂无
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
104-COMP
引用
收藏
页数:1
相关论文
共 50 条
[11]   GRADIENT CORRECTIONS IN DENSITY-FUNCTIONAL THEORY CALCULATIONS FOR SURFACES - CO ON PD(110) [J].
HU, P ;
KING, DA ;
CRAMPIN, S ;
LEE, MH ;
PAYNE, MC .
CHEMICAL PHYSICS LETTERS, 1994, 230 (06) :501-506
[12]   Density functional theory study of hydrogenation of S to H2S on Pt-Pd alloy surfaces [J].
Liu, Yunjie ;
Guo, Wenyue ;
Lu, Xiaoqing ;
Gao, Wei ;
Li, Guixia ;
Guo, Yahui ;
Zhu, Jun ;
Hao, Lanzhong .
RSC ADVANCES, 2016, 6 (08) :6289-6299
[13]   Ethanol Reforming on Co(0001) Surfaces: A Density Functional Theory Study [J].
Ma, Yuguang ;
Hernandez, Liliana ;
Guadarrama-Perez, Carlos ;
Balbuena, Perla B. .
JOURNAL OF PHYSICAL CHEMISTRY A, 2012, 116 (05) :1409-1416
[14]   Density functional theory study of Fe(II) adsorption and oxidation on goethite surfaces [J].
Russell, Benedict ;
Payne, Mike ;
Ciacchi, Lucio Colombi .
PHYSICAL REVIEW B, 2009, 79 (16)
[15]   Methanol oxidation on the PtPd(111) alloy surface: A density functional theory study [J].
Xu, Jing ;
Guo, Sheng ;
Hou, Fei ;
Li, Jing ;
Zhao, Lianming .
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2018, 118 (03)
[16]   Density functional theory study of Cu adhesion on Rh, Ir, Pd, Ta, Mo, Ru, Co, and Os surfaces [J].
State Key Lab of ASIC and Systems, Department of Microelectronics, Fudan University, Shanghai 200433, China .
Jpn. J. Appl. Phys., 10 PART 1
[17]   COMP 71-Density functional theory study of Pt and Pd-based pseudomorphic monolayer alloy catalysts for NOx storage reduction applications [J].
Jelic, Jelena ;
Meyer, Randall J. .
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2008, 235
[18]   A comparative study of atomic oxygen adsorption at Pd surfaces from Density Functional Theory [J].
Bukas, Vanessa J. ;
Reuter, Karsten .
SURFACE SCIENCE, 2017, 658 :38-45
[19]   Density Functional Theory Study of p-Chloroaniline Adsorption on Pd Surfaces and Clusters [J].
He, Xiaobo ;
Lyu, Jinghui ;
Zhou, Hu ;
Zhuang, Guilin ;
Zhong, Xing ;
Wang, Jian-Guo ;
Li, Xiaonian .
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2014, 114 (14) :895-899
[20]   Density functional theory study of CO catalytic oxidation on Pt(111) and Pt3Ni(111) surfaces [J].
Su Haiyan ;
Li Weixue ;
Bao Xinhe .
CHINESE JOURNAL OF CATALYSIS, 2008, 29 (08) :683-686