Local thermodynamic properties of a stepped metal surface: Cu(711)

被引:30
作者
Kara, A
Durukanoglu, S
Rahman, TS
机构
[1] Department of Physics, Cardwell Hall, Kansas State University, Manhattan
来源
PHYSICAL REVIEW B | 1996年 / 53卷 / 23期
关键词
D O I
10.1103/PhysRevB.53.15489
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
Using a real-space Green's-function approach to determine the local vibrational density of states with force constants extracted from interaction potentials based on the embedded-atom method, we show that the vibrational free energy and the heat capacity of the step and the terrace atoms on Cu(711) are sensitive to the local atomic environment. We find the vibrational contribution to the excess free energy of the step atoms near room temperature to be a significant fraction of the kink formation energy. Also, the low-temperature heat capacity of the step and terrace atoms exhibit a T-2.2+/-0.1 dependence.
引用
收藏
页码:15489 / 15492
页数:4
相关论文
共 32 条
  • [1] MAGNITUDE AND ORIGIN OF THE DIFFERENCE IN VIBRATIONAL ENTROPY BETWEEN ORDERED AND DISORDERED FE3AL
    ANTHONY, L
    NAGEL, LJ
    OKAMOTO, JK
    FULTZ, B
    [J]. PHYSICAL REVIEW LETTERS, 1994, 73 (22) : 3034 - 3037
  • [2] THERMAL-EXPANSION OF SOLIDS AT LOW-TEMPERATURES
    BARRON, THK
    COLLINS, JG
    WHITE, GK
    [J]. ADVANCES IN PHYSICS, 1980, 29 (04) : 609 - 730
  • [3] THE EQUILIBRIUM CRYSTAL SHAPE AND THE ROUGHENING TRANSITION ON METAL-SURFACES
    CONRAD, EH
    ENGEL, T
    [J]. SURFACE SCIENCE, 1994, 299 (1-3) : 391 - 404
  • [4] THE EMBEDDED-ATOM METHOD - A REVIEW OF THEORY AND APPLICATIONS
    DAW, MS
    FOILES, SM
    BASKES, MI
    [J]. MATERIALS SCIENCE REPORTS, 1993, 9 (7-8): : 251 - 310
  • [5] DURUKANOGLU S, UNPUB
  • [6] EXACT SOLUTION FOR THE RESOLVENT MATRIX OF A GENERALIZED TRIDIAGONAL HAMILTONIAN
    DY, KS
    WU, SY
    SPRATLIN, T
    [J]. PHYSICAL REVIEW B, 1979, 20 (10) : 4237 - 4243
  • [7] EVALUATION OF HARMONIC METHODS FOR CALCULATING THE FREE-ENERGY OF DEFECTS IN SOLIDS
    FOILES, SM
    [J]. PHYSICAL REVIEW B, 1994, 49 (21): : 14930 - 14938
  • [8] FOILES SM, 1986, PHYS REV B, V33, P7983, DOI 10.1103/PhysRevB.33.7983
  • [9] FRIEDEL J, 1964, INTERACTION RAD SOLI
  • [10] FRIEDEL J, 1962, SUMMER SCH RAD DAMAG