MO CALCULATIONS ON EXTENDED CLUSTERS OF YBA2CU3O7

被引:1
作者
BOUDREAUX, EA
BAXTER, E
机构
关键词
D O I
10.1080/00268949008031785
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:349 / 357
页数:9
相关论文
共 15 条
[1]   AN SC-MEH MOLECULAR-ORBITAL STUDY OF HCO(CO)4 AND CO(CO)4 [J].
BOUDREAUX, EA .
INORGANICA CHIMICA ACTA-ARTICLES AND LETTERS, 1984, 82 (02) :183-195
[2]  
BOUDREAUX EA, 1986, INT J QUANTUM CHEM, P239
[3]  
BOUDREAUX EA, 1989, 1988 P INT C 1ST 2 Y, P379
[4]  
BOUDREAUX EA, 1989, INT J QUANT CHEM
[5]  
CARSEY TP, 1974, THEORET CHIM ACTA, V9
[6]   CLUSTER STUDIES OF THE ELECTRONIC-STRUCTURE OF CU-O CHAINS IN HIGH-TEMPERATURE SUPERCONDUCTORS [J].
CHEN, H ;
CALLAWAY, J ;
MISRA, PK .
PHYSICAL REVIEW B, 1987, 36 (16) :8863-8865
[7]   INVESTIGATIONS IN SEMIEMPIRICAL MOLECULAR-ORBITAL METHODS .2. COMPUTATIONAL RESULTS FOR OCTAHEDRAL FLUORIDES TIF63-,CRF63-,FEF63-,AND NIF64- [J].
DUTTAAHMED, A ;
BOUDREAU.EA .
INORGANIC CHEMISTRY, 1973, 12 (07) :1597-1602
[8]  
DUTTAAHMED A, 1973, INORG CHEM, V12, P1590
[9]   MAGNETIC-SUSCEPTIBILITY OF YBA2CU3O6+X - EFFECTS OF SPIN FRUSTRATION AND CORRELATION [J].
FARNETH, WE ;
MCLEAN, RS ;
MCCARRON, EM ;
ZUO, F ;
LU, Y ;
PATTON, BR ;
EPSTEIN, AJ .
PHYSICAL REVIEW B, 1989, 39 (10) :6594-6599
[10]   ELECTRONIC-STRUCTURE AND VALENCE-BOND BAND-STRUCTURE OF CUPRATE SUPERCONDUCTING MATERIALS [J].
GUO, YJ ;
LANGLOIS, JM ;
GODDARD, WA .
SCIENCE, 1988, 239 (4842) :896-899