VALENCE ELECTRONIC-STRUCTURE OF POLYSTYRENES WITH DIFFERENT TACTICITIES - HOW TO GO (OR NOT TO GO) TOO FAR - A JOINT THEORETICAL AND EXPERIMENTAL APPROACH

被引:12
作者
ORTI, E
BREDAS, JL
PIREAUX, JJ
ISHIHARA, N
机构
[1] UNIV MONS,SERV CHIM MAT NOUVEAUX,B-7000 MONS,BELGIUM
[2] UNIV MONS,DEPT MAT & PROCEDES,B-7000 MONS,BELGIUM
[3] FAC UNIV NOTRE DAME PAIX,INTERDISCIPLINAIRE SPECTROSCOPIE ELECTR LAB,B-5000 NAMUR,BELGIUM
[4] IDEMITSU KOSAN CO LTD,CENT RES LABS,SODEGAURA,CHIBA 29902,JAPAN
关键词
D O I
10.1016/0368-2048(90)85047-D
中图分类号
O433 [光谱学];
学科分类号
0703 ; 070302 ;
摘要
Monochromadzed Al-Kα XPS spectra from iso- and syndiotacdc polystyrenes are analyzed with the help of theoretical band structures and densities of states produced from a valence effective Hamiltonian (VEH) computation scheme. A discussion of the correlations found between the experimental and theoretical results points out to the potentialities but also to the limits of both methods. © 1990.
引用
收藏
页码:551 / 570
页数:20
相关论文
共 44 条
[1]  
ANDRE JM, 1981, PHOTON ELECTRON ION, P153
[2]  
ANDRE JM, 1979, INT J QUANTUM CHEM, V13, P283
[3]  
[Anonymous], 1955, NOI DONNE 0417, P16
[4]   X-RAY PHOTOELECTRON SPECTROSCOPIC AND THEORETICAL-STUDY OF THE CONFORMATIONAL DEPENDENCE OF THE VALENCE ELECTRONIC LEVELS IN HEXAGONAL AND ORTHORHOMBIC POLY(OXYMETHYLENES) [J].
BOULANGER, P ;
RIGA, J ;
VERBIST, JJ ;
DELHALLE, J .
MACROMOLECULES, 1989, 22 (01) :173-179
[5]   ELECTRONIC-PROPERTIES OF SULFUR-CONTAINING CONJUGATED POLYMERS [J].
BREDAS, JL ;
ELSENBAUMER, RL ;
CHANCE, RR ;
SILBEY, R .
JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (09) :5656-5662
[6]   ELECTRONIC-STRUCTURE OF POLYSTYRENE - A VALENCE EFFECTIVE HAMILTONIAN THEORETICAL-STUDY [J].
BREDAS, JL ;
STREET, GB .
JOURNAL OF CHEMICAL PHYSICS, 1985, 82 (07) :3284-3288
[7]   VALENCE EFFECTIVE HAMILTONIAN STUDY OF THE ELECTRONIC-STRUCTURE OF POLYSULFUR NITRIDE, (SN)X [J].
BREDAS, JL .
CHEMICAL PHYSICS LETTERS, 1985, 115 (02) :119-123
[8]   A NON-EMPIRICAL EFFECTIVE HAMILTONIAN TECHNIQUE FOR POLYMERS - APPLICATION TO POLYACETYLENE AND POLYDIACETYLENE [J].
BREDAS, JL ;
CHANCE, RR ;
SILBEY, R ;
NICOLAS, G ;
DURAND, P .
JOURNAL OF CHEMICAL PHYSICS, 1981, 75 (01) :255-267
[9]   ELECTRONIC-STRUCTURE EVOLUTION UPON THERMAL-TREATMENT OF POLYACRYLONITRILE - A THEORETICAL INVESTIGATION [J].
BREDAS, JL ;
SALANECK, WR .
JOURNAL OF CHEMICAL PHYSICS, 1986, 85 (04) :2219-2226
[10]   VALENCE EFFECTIVE HAMILTONIAN STUDY OF THE ELECTRONIC-STRUCTURE OF POLY(PARA-PHENYLENE) AND POLY(PARA-PHENYLENE SULFIDE) [J].
BREDAS, JL ;
CHANCE, RR ;
SILBEY, R ;
NICOLAS, G ;
DURAND, P .
JOURNAL OF CHEMICAL PHYSICS, 1982, 77 (01) :371-378