Simulation of kinetic oscillations in catalytic reactions accompanied by adsorbate-induced surface restructuring

被引：41

作者：

Zhdanov, VP ^{[1
]}

机构：

[1] Chalmers Univ Technol, Dept Appl Phys, S-41296 Gothenburg, Sweden

[2] Russian Acad Sci, Boreskov Inst Catalysis, Novosibirsk 630090, Russia

来源：

SURFACE SCIENCE | 1999年 / 426卷 / 03期

关键词：

computer simulations; models of surface chemical reactions; surface reconstruction;

D O I：

10.1016/S0039-6028(99)00328-3

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

We present Monte Carlo simulations of phase separation on the nanometer scale during kinetic oscillations in catalytic reactions accompanied by adsorbate-induced surface restructuring. As an example, we analyze the 2A + B-2 --> 2AB reaction mimicking CO oxidation on noble metals. The lattice-gas model employed to describe surface restructuring and the reaction steps takes into account substrate-substrate, substrate-adsorbate and adsorbate-adsorbate lateral interactions and predicts the formation of restructured islands even at low A coverages [as in the case of CO adsorption on Pt(100)]. (C) 1999 Elsevier Science B.V. All rights reserved.

引用

页码：345 / 357

页数：13

共 50 条

[41] Oscillations in catalytic reactions: Carbon model with adsorbate-adsorbate lateral interactions
Zhdanov, VP
[J]. SURFACE REVIEW AND LETTERS, 2001, 8 (1-2) : 51 - 59
[42] Adsorbate-induced restructuring of Pb mesas grown on vicinal Si(111) in the quantum regime
Khajetoorians, Alexander Ako
Zhu, Wenguang
Kim, Jisun
Qin, Shengyong
Eisele, Holger
Zhang, Zhenyu
Shih, Chih-Kang
[J]. PHYSICAL REVIEW B, 2009, 80 (24):
[43] Adsorbate-induced surface rearrangement of the system Pd/Mo(111)
Danko, DB
Kuchowicz, M
Kolaczkiewicz, J
[J]. SURFACE SCIENCE, 2004, 552 (1-3) : 111 - 122
[44] ADSORBATE-INDUCED SURFACE-PHONON SOFTENING ON PT(111)
NEUHAUS, D
JOO, F
FEUERBACHER, B
[J]. PHYSICAL REVIEW LETTERS, 1987, 58 (07) : 694 - 697
[45] ADSORBATE-INDUCED SURFACE EXPANSION - INDICATOR OF THE PROPENSITY FOR A STRUCTURAL TRANSFORMATION
SCHEUCH, V
KISKINOVA, M
BONZEL, HPP
UEBING, C
[J]. PHYSICAL REVIEW B, 1995, 51 (03): : 1973 - 1976
[46] ON THE THEORY OF PHOTOEMISSION FROM ADSORBATE-INDUCED SURFACE-STATES
BECKMANN, A
[J]. PHYSICA STATUS SOLIDI B-BASIC RESEARCH, 1987, 144 (01): : 213 - 224
[47] ADSORBATE-INDUCED STRUCTURE TRANSITIONS AT THE RECONSTRUCTED PT(100) SURFACE
RADNIK, J
GITMANS, F
PENNEMANN, B
OSTER, K
WANDELT, K
[J]. SURFACE SCIENCE, 1993, 287 (pt A) : 330 - 335
[48] Adsorbate-Induced Surface Segregation for Core-Shell Nanocatalysts
Mayrhofer, Karl J. J.
Juhart, Viktorija
Hartl, Katrin
Hanzlik, Marianne
Arenz, Matthias
[J]. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2009, 48 (19) : 3529 - 3531
[49] Understanding adsorbate-induced surface segregation in PtCo/C electrocatalyst
Budiman, Abdul Hamid
Purwanto, Widodo Wahyu
Dewi, Eniya Listiani
Dalimi, Rinaldy
Hwang, Bing Joe
[J]. ASIA-PACIFIC JOURNAL OF CHEMICAL ENGINEERING, 2012, 7 (04) : 604 - 612
[50] THE EFFECT OF ADSORBATE-INDUCED CHANGES IN THE SURFACE ON THERMAL-DESORPTION
ZHDANOV, VP
[J]. SURFACE SCIENCE, 1991, 257 (1-3) : 344 - 352

← 1 2 3 4 5 →