EFFECTS OF REPULSIVE INTERACTIONS ON BONDINGS IN YBA2CU3OX

被引:0
作者
IGUCHI, E
YONEZAWA, Y
机构
[1] Department of Mechanical Engineering and Materials Science, Faculty of Engineering, Yokohama National University, Hodogaya-ku, Yokohama, 240, Tokiwadi
关键词
D O I
10.1016/0167-2738(90)90123-9
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The repulsive energies between ions in YBa2Cu3Ox were calculated using Wedepohl's free ion model. They were tested by using them to study cohesive energies and lattice constants of Y2O3, BaO and CuO. We have discussed the effects of repulsive interactions on bond-natures in YBa2Cu3Ox by considering similarities of bonds in these oxides to YBa2Cu3Ox and elastic constants. This compound is likely to contain some covalent contributions due to Cu-O bondings. © 1990.
引用
收藏
页码:795 / 798
页数:4
相关论文
共 20 条
[11]  
Kittel C., 1971, INTRO SOLID STATE PH
[12]  
KRISHNAN K, 1942, P ROY SOC LOND A MAT, V210, P481
[13]  
Ledbetter H. M., 1987, Journal of Materials Research, V2, P786, DOI 10.1557/JMR.1987.0786
[14]  
Pauling L, 1927, PROC ROYSOC A, V114, P191, DOI [10.2307/94742, DOI 10.2307/94742]
[15]  
SAMSONOV GV, 1973, OXIDES HDB
[16]   REVISED VALUES OF EFFECTIVE IONIC RADII [J].
SHANNON, RD ;
PREWITT, CT .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1970, B 26 :1046-&
[17]   ELECTRONIC POLARIZABILITIES OF IONS IN CRYSTALS [J].
TESSMAN, JR ;
KAHN, AH ;
SHOCKLEY, W .
PHYSICAL REVIEW, 1953, 92 (04) :890-895
[18]   HYBRID THOMAS-FERMI-DIRAC METHOD FOR CALCULATING ATOMIC INTERACTION ENERGIES .2. RESULTS AND COMPARISON WITH EXPERIMENTAL-DATA [J].
WEDEPOHL, PT .
JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1977, 10 (11) :1865-1874
[19]   HYBRID THOMAS-FERMI-DIRAC METHOD FOR CALCULATING ATOMIC INTERACTION ENERGIES .1. THEORY [J].
WEDEPOHL, PT .
JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1977, 10 (11) :1855-1864
[20]   INFLUENCE OF ELECTRON DISTRIBUTION ON ATOMIC INTERACTION POTENTIALS [J].
WEDEPOHL, PT .
PROCEEDINGS OF THE PHYSICAL SOCIETY OF LONDON, 1967, 92 (575P) :79-&