MOLECULAR-ORBITAL THEORY FOR THE ANALYSIS OF PHOTOEMISSION SPECTRA

被引:56
作者
BAGUS, PS
COOLBAUGH, D
KOWALCZYK, SP
PACCHIONI, G
PARMIGIANI, F
机构
[1] IBM CORP AUSTIN,AUSTIN,TX
[2] IBM CORP,THOMAS J WATSON RES CTR,YORKTOWN HTS,NY 10598
[3] UNIV MILAN,DEPT INORGAN CHEM,I-20122 MILAN,ITALY
[4] CTR INFORMAZ STUDI ESPERIENZE SPA,I-20134 MILAN,ITALY
关键词
D O I
10.1016/0368-2048(90)80142-W
中图分类号
O433 [光谱学];
学科分类号
0703 ; 070302 ;
摘要
Molecular orbital theory contributes significantly to the understanding of photoemission spectra; in particular, theory can separate individual effects which are difficult to distinguish experimentally. Two recent theoretical studies are reviewed to show the kind of information which can be obtained. © 1990.
引用
收藏
页码:69 / 74
页数:6
相关论文
共 17 条
[1]  
ABERG T, 1967, PHYS REV, V156, P142
[2]   SYMMETRY ADAPTED VERSUS SYMMETRY BROKEN WAVEFUNCTIONS - THE 1S CORE LEVEL IONS OF O+2 [J].
AGREN, H ;
BAGUS, PS ;
ROOS, BO .
CHEMICAL PHYSICS LETTERS, 1981, 82 (03) :505-510
[3]   LOCALIZED AND DELOCALIZED 1S HOLE STATES OF O2+ MOLECULAR ION [J].
BAGUS, PS ;
SCHAEFER, HF .
JOURNAL OF CHEMICAL PHYSICS, 1972, 56 (01) :224-&
[4]   ANOMALOUS MULTIPLET-SPLITTING INTENSITY RATIOS IN K-LEVEL X-RAY PHOTOEMISSION SPECTRA OF NO AND O2 [J].
BAGUS, PS ;
SCHRENK, M ;
DAVIS, DW ;
SHIRLEY, DA .
PHYSICAL REVIEW A, 1974, 9 (03) :1090-1096
[5]   SURFACE-ATOM X-RAY PHOTOEMISSION FROM CLEAN METALS - CU, AG, AND AU [J].
CITRIN, PH ;
WERTHEIM, GK ;
BAER, Y .
PHYSICAL REVIEW B, 1983, 27 (06) :3160-3175
[6]  
COOLBAUGH D, IN PRESS
[7]   CHARACTERIZATION OF ULTRATHIN POLYIMIDE FILMS (D APPROXIMATELY 11 A) FORMED BY VAPOR-DEPOSITION OF 4,4-OXIDIANILINE AND 1,2,4,5-BENZENETETRACARBOXYLIC ANHYDRIDE [J].
GRUNZE, M ;
LAMB, RN .
JOURNAL OF VACUUM SCIENCE & TECHNOLOGY A-VACUUM SURFACES AND FILMS, 1987, 5 (04) :1685-1686
[8]   BINDING AND ENERGY-LEVEL SHIFTS OF CARBON-MONOXIDE ADSORBED ON NICKEL - MODEL STUDIES [J].
HERMANN, K ;
BAGUS, PS .
PHYSICAL REVIEW B, 1977, 16 (10) :4195-4208
[9]   SIZE DEPENDENCE OF SURFACE CLUSTER-MODELS - CO ADSORBED ON CU(100) [J].
HERMANN, K ;
BAGUS, PS ;
NELIN, CJ .
PHYSICAL REVIEW B, 1987, 35 (18) :9467-9473
[10]   LOCAL MODELS FOR THE INTERACTION OF ADSORBATES WITH SURFACES [J].
HERMANN, K ;
BAGUS, PS .
APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING, 1987, 44 (01) :63-73