ELECTRON MOMENTUM DISTRIBUTION AND COMPTON PROFILES OF CRYSTALLINE RARE-GASES BY THE AUGMENTED-PLANE-WAVE METHOD

被引:2
作者
BACALIS, NC
PAPANICOLAOU, NI
机构
[1] RES CTR CRETE,GR-71110 HERAKLION,GREECE
[2] UNIV IOANNINA,DEPT PHYS,POB 1186,GR-45110 IOANNINA,GREECE
来源
PHYSICA STATUS SOLIDI B-BASIC RESEARCH | 1990年 / 157卷 / 01期
关键词
D O I
10.1002/pssb.2221570130
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
A systematic study of directional electron momentum distributions and Compton profiles of the inert gas solids is presented, performed within the augmented‐plane‐wave method using the exchange and correlation of Hedin and Lundqvist which is well known to be the most reliable approximation for valence band properties of the rare gas crystals. Directional anisotropies in the Compton profiles are observed which are larger than existing ones from Hartree‐Fock calculations. Copyright © 1990 WILEY‐VCH Verlag GmbH & Co. KGaA
引用
收藏
页码:293 / 304
页数:12
相关论文
共 32 条
[1]   ENERGY-BANDS FOR SOLID ARGON [J].
AZUMA, M .
JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN, 1980, 49 (06) :2141-2143
[2]   VARIOUS APPROXIMATIONS MADE IN AUGMENTED-PLANE-WAVE CALCULATIONS [J].
BACALIS, NC ;
BLATHRAS, K ;
THOMAIDES, P ;
PAPACONSTANTOPOULOS, DA .
PHYSICAL REVIEW B, 1985, 32 (08) :4849-4856
[3]   THEORETICAL COMPTON PROFILES DUE TO VALENCE-ELECTRONS OF TI AND TIH2 [J].
BACALIS, NC ;
PAPANICOLAOU, NI ;
PAPACONSTANTOPOULOS, DA .
JOURNAL OF PHYSICS F-METAL PHYSICS, 1986, 16 (10) :1471-1483
[4]   SYSTEMATIC CALCULATIONS OF THE BAND STRUCTURES OF THE RARE-GAS CRYSTALS NEON, ARGON, KRYPTON, AND XENON [J].
BACALIS, NC ;
PAPACONSTANTOPOULOS, DA ;
PICKETT, WE .
PHYSICAL REVIEW B, 1988, 38 (09) :6218-6226
[5]  
Biggs F., 1975, Atomic Data and Nuclear Data Tables, V16, P201, DOI 10.1016/0092-640X(75)90030-3
[6]   EQUATION OF STATE AND METALLIZATION OF NEON [J].
BOETTGER, JC .
PHYSICAL REVIEW B, 1986, 33 (10) :6788-6791
[7]   HARTREE-FOCK BAND-STRUCTURE AND OPTICAL GAP IN SOLID NEON AND ARGON [J].
DAGENS, L ;
PERROT, F .
PHYSICAL REVIEW B, 1972, 5 (02) :641-&
[8]   HARTREE-FOCK CALCULATIONS FOR CRYSTALLINE NE AND LIF [J].
EUWEMA, RN ;
WEPFER, GG ;
SURRATT, GT ;
WILHITE, DL .
PHYSICAL REVIEW B, 1974, 9 (12) :5249-5256
[9]   EFFECT OF SYMMETRY ON ELECTRON MOMENTUM DISTRIBUTIONS IN SOLIDS [J].
HARTHOORN, R ;
MIJNARENDS, PE .
JOURNAL OF PHYSICS F-METAL PHYSICS, 1978, 8 (06) :1147-1158
[10]   EXPLICIT LOCAL EXCHANGE-CORRELATION POTENTIALS [J].
HEDIN, L ;
LUNDQVIS.BI .
JOURNAL OF PHYSICS PART C SOLID STATE PHYSICS, 1971, 4 (14) :2064-&