ELECTRONIC-STRUCTURES OF BANIS2 AND BACOS2

被引：19
|
作者：
HASE, I
SHIRAKAWA, N
NISHIHARA, Y
机构：
[1] Electrotechnical Laboratory
来源：
JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN | 1995年 / 64卷 / 07期
关键词：
BACO1-XNIXS2; ELECTRONIC STRUCTURE; BAND-STRUCTURE CALCULATION; FERMI SURFACES; DIMENSIONALITY;
D O I：
10.1143/JPSJ.64.2533
中图分类号：
O4 [物理学];
学科分类号：
0702 ;
摘要：
The electronic energy band structures for BaNiS2 and BaCoS2, which are considered as highly correlated layered structure systems, have been calculated by using the scalar-relativistic full-potential linearized augmented plane wave (FLAPW) method within the local-density approximation. The result of the calculation suggests that both compounds are compensated metals. It is found that the calculated Fermi surfaces of both compounds have three-dimensional characters.
引用
收藏
页码：2533 / 2540
页数：8
相关论文
共 50 条
  • [41] ABINITIO STUDIES OF THE GEOMETRIES AND ELECTRONIC-STRUCTURES OF CAF2 AND CACL2
    SALZNER, U
    SCHLEYER, PV
    CHEMICAL PHYSICS LETTERS, 1990, 172 (06) : 461 - 470
  • [42] EFFECTS OF IRON INTERCALATION ON THE ELECTRONIC-STRUCTURES OF ZRS2 AND HFS2
    IWASAKI, T
    KURODA, N
    NISHINA, Y
    SYNTHETIC METALS, 1983, 6 (2-3) : 157 - 163
  • [43] ELECTRONIC-STRUCTURES OF POLYACETYLENE
    YAMABE, T
    TANAKA, K
    FUKUI, K
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1979, (APR): : 183 - &
  • [44] ELECTRONIC-STRUCTURES OF INTERCALATION COMPLEXES OF THE LAYERED COMPOUND 2H-TAS2
    GUO, GY
    LIANG, WY
    JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1987, 20 (27): : 4315 - 4334
  • [45] THE CRYSTAL AND ELECTRONIC-STRUCTURES OF A NEW MOLECULAR CONDUCTOR, (HMTTEF)2[PT(DMIT)2]
    KOBAYASHI, A
    SASAKI, Y
    KATO, R
    KOBAYASHI, H
    CHEMISTRY LETTERS, 1986, (03) : 387 - 390
  • [46] TRANSITION-STATE ELECTRONIC-STRUCTURES IN SN2 REACTIONS
    SHI, Z
    BOYD, RJ
    JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1989, 111 (05) : 1575 - 1579
  • [47] ELECTRONIC-STRUCTURES OF POLYMERIC CSE2, CSE, AND C2SE
    SPRINGBORG, M
    PHYSICAL REVIEW B, 1989, 39 (08): : 5327 - 5344
  • [48] MAGNETO-OPTICAL SPECTRUM AND ELECTRONIC-STRUCTURES OF COS2
    SATO, K
    TERANISHI, T
    JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS, 1983, 31-4 (FEB) : 333 - 334
  • [49] GEOMETRICAL AND ELECTRONIC-STRUCTURES OF 2 CONFORMERS OF VINYL ISOCYANATE BY MICROWAVE SPECTROSCOPY
    BOUCHY, A
    ROUSSY, G
    JOURNAL OF MOLECULAR SPECTROSCOPY, 1977, 68 (01) : 156 - 165
  • [50] CRYSTAL AND ELECTRONIC-STRUCTURES OF (BEDSE-TSEF)AUBR2
    KATO, R
    KOBAYASHI, H
    KOBAYASHI, A
    MORI, T
    INOKUCHI, H
    CHEMISTRY LETTERS, 1987, (02) : 277 - 280
12345