SELF-CONSISTENT LMTO BAND CALCULATIONS ON A15 COMPOUNDS

被引:49
作者
JARLBORG, T [1 ]
机构
[1] CHALMERS UNIV TECHNOL,DEPT PHYS,S-40220 GOTHENBURG 5,SWEDEN
来源
JOURNAL OF PHYSICS F-METAL PHYSICS | 1979年 / 9卷 / 02期
关键词
D O I
10.1088/0305-4608/9/2/018
中图分类号
O59 [应用物理学];
学科分类号
摘要
The canonical and LMTO band methods have been used in self-consistent band calculations on 27 A15 compounds. The calculations are described and the basic results, in the form of density of state diagrams and charge analyses for each compound, are presented.
引用
收藏
页码:283 / 305
页数:23
相关论文
共 14 条
[1]   ADVANCES IN THEORY OF ONE-ELECTRON ENERGY-STATES [J].
ANDERSEN, OK ;
JEPSEN, O .
PHYSICA B & C, 1977, 91 (JUL) :317-328
[2]   LINEAR METHODS IN BAND THEORY [J].
ANDERSEN, OK .
PHYSICAL REVIEW B, 1975, 12 (08) :3060-3083
[3]   TREND STUDIES OF A15 COMPOUNDS BY SELF-CONSISTENT BAND CALCULATIONS [J].
ARBMAN, G ;
JARLBORG, T .
SOLID STATE COMMUNICATIONS, 1978, 26 (11) :857-861
[4]   ELECTRONIC BAND-STRUCTURE OF V3 GA .2. [J].
GOLDBERG, IB .
JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1975, 8 (08) :1159-1180
[5]   LOCAL EXCHANGE-CORRELATION POTENTIALS [J].
HEDIN, L ;
LUNDQVIST, BI ;
LUNDQVIST, S .
SOLID STATE COMMUNICATIONS, 1971, 9 (09) :537-+
[6]   LMTO BAND METHOD APPLIED TO V-3GA [J].
JARLBORG, T ;
ARBMAN, G .
JOURNAL OF PHYSICS F-METAL PHYSICS, 1976, 6 (02) :189-197
[7]   ELECTRONIC-STRUCTURE OF SOME A15 COMPOUNDS BY SEMI-SELF-CONSISTENT BAND CALCULATIONS [J].
JARLBORG, T ;
ARBMAN, G .
JOURNAL OF PHYSICS F-METAL PHYSICS, 1977, 7 (09) :1635-1649
[8]  
JARLBORG T, 1978, THESIS CHALMERS U TE
[9]   SELF-CONSISTENT APW BANDSTRUCTURE OF V3GA [J].
KLEIN, BM ;
BOYER, LL ;
PAPACONSTANTOPOULOS, DA .
JOURNAL OF PHYSICS F-METAL PHYSICS, 1978, 8 (04) :617-621
[10]   PHONON PROPERTIES OF A-15 SUPERCONDUCTORS OBTAINED FROM HEAT-CAPACITY MEASUREMENTS [J].
KNAPP, GS ;
BADER, SD ;
FISK, Z .
PHYSICAL REVIEW B, 1976, 13 (09) :3783-3789