EXACT EIGENVALUE EQUATION FOR A FINITE AND INFINITE COLLECTION OF MUFFIN-TIN POTENTIALS - COMMENT

被引:5
作者
GONIS, A
ZELLER, R
DEDERICHS, PH
FAULKNER, JS
GYORFFY, BL
NICHOLSON, DM
STOCKS, GM
WILLE, LT
ZHANG, XG
机构
[1] FORSCHUNGSZENTRUM JULICH, INST FESTKORPERPHYS, W-5170 JULICH 1, GERMANY
[2] FLORIDA ATLANTIC UNIV, DEPT PHYS, BOCA RATON, FL 33431 USA
[3] UNIV BRISTOL, HH WILLS PHYS LAB, BRISTOL BS8 1TL, AVON, ENGLAND
[4] OAK RIDGE NATL LAB, DIV MET & CERAM, OAK RIDGE, TN 37831 USA
来源
PHYSICAL REVIEW B | 1990年 / 41卷 / 14期
关键词
D O I
10.1103/PhysRevB.41.10224
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
In a recent paper, Badralexe and Freeman purport to provide a proof to the effect that the multiple-scattering-theory treatment of waves propagating through a set of potential cells bounded by nonoverlapping spheres, muffin-tin potentials, is valid only in the limit in which the radius of the sphere vanishes (-function potentials). In particular, the authors claim that the well-known Korringa-Kohn-Rostoker method for determining the electronic structure of solids leads to a secular equation which is only approximately valid and cannot give the exact energy levels. It is the purpose of this paper to disprove this claim. © 1990 The American Physical Society.
引用
收藏
页码:10224 / 10225
页数:2
相关论文
共 18 条
  • [11] MORUZZI VL, 1978, CALCULATED ELECTRONI
  • [12] USE OF GENERAL POTENTIALS IN MULTIPLE-SCATTERING THEORY
    NATOLI, CR
    BENFATTO, M
    DONIACH, S
    [J]. PHYSICAL REVIEW A, 1986, 34 (06): : 4682 - 4694
  • [13] Rayleigh L., 1892, PHILOS MAG, V34, P481, DOI [10.1080/14786449208620364, DOI 10.1080/14786449208620364]
  • [14] Wave functions in a periodic potential
    Slater, JC
    [J]. PHYSICAL REVIEW, 1937, 51 (10): : 0846 - 0851
  • [15] MULTIPLE-SCATTERING BY NON-MUFFIN-TIN POTENTIALS - GENERAL FORMULATION
    WILLIAMS, AR
    MORGAN, JVW
    [J]. JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1974, 7 (01): : 37 - 60
  • [16] FULL-POTENTIAL SELF-CONSISTENT LINEARIZED-AUGMENTED-PLANE-WAVE METHOD FOR CALCULATING THE ELECTRONIC-STRUCTURE OF MOLECULES AND SURFACES - O2 MOLECULE
    WIMMER, E
    KRAKAUER, H
    WEINERT, M
    FREEMAN, AJ
    [J]. PHYSICAL REVIEW B, 1981, 24 (02): : 864 - 875
  • [17] MULTIPLE-SCATTERING SOLUTION OF SCHRODINGER-EQUATION FOR POTENTIALS OF GENERAL SHAPE
    ZELLER, R
    [J]. JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1987, 20 (16): : 2347 - 2360
  • [18] Ziesche P, 1983, ERGEBNISSE ELEKTRONE