CNDO-S CALCULATIONS OF MAGNETIC CIRCULAR-DICHROISM OF POLYACENES

被引:20
作者
OBBINK, JH [1 ]
HEZEMANS, AMF [1 ]
机构
[1] STATE UNIV UTRECHT,ALGEMENE CHEM LAB,UTRECHT,NETHERLANDS
关键词
D O I
10.1016/0009-2614(77)80696-9
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
引用
收藏
页码:133 / 137
页数:5
相关论文
共 22 条
[1]   2-PHOTON SPECTROSCOPY UTILIZING DYE LASERS [J].
BERGMAN, A ;
JORTNER, J .
CHEMICAL PHYSICS LETTERS, 1972, 15 (03) :309-&
[2]   EXPERIMENTAL-STUDY OF NEGATIVE-ION STATES OF STYRENE - TEST OF PAIRING THEOREM [J].
BURROW, PD ;
MICHEJDA, JA ;
JORDAN, KD .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1976, 98 (20) :6392-6393
[3]  
DELBENE J, 1968, J CHEM PHYS, V48, P1807
[4]   USE OF CNDO METHOD IN SPECTROSCOPY - NAPHTHALENE AND BREAKDOWN OF PAIRING THEOREMS .12. [J].
ELLIS, RL ;
JAFFE, HH .
JOURNAL OF MOLECULAR SPECTROSCOPY, 1974, 50 (1-3) :474-482
[5]  
HEZEMANS AMF, TO BE PUBLISHED
[6]   BETA PARAMETERS FOR NON-NEAREST NEIGHBORS [J].
JUG, K .
THEORETICA CHIMICA ACTA, 1971, 23 (01) :93-&
[7]   SPECTRAL RESEMBLANCES OF CATA-CONDENSED HYDROCARBONS [J].
KLEVENS, HB ;
PLATT, JR .
JOURNAL OF CHEMICAL PHYSICS, 1949, 17 (05) :470-481
[8]   MAGNETIC CIRCULAR DICHROISM OF ALPHA-BANDS OF SOME POLYCYCLIC AROMATIC HYDROCARBONS [J].
LARKINDALE, JP ;
SIMKIN, DJ .
JOURNAL OF CHEMICAL PHYSICS, 1971, 55 (12) :5668-+
[9]   Consistency requirement in the pariser-parr-pople model [J].
Linderberc, Jan .
CHEMICAL PHYSICS LETTERS, 1967, 1 (02) :39-41
[10]   ACCURATE HEATS OF ATOMIZATION AND ACCURATE BOND LENGTHS .I. BENZENOID HYDROCARBONS [J].
LO, DH ;
WHITEHEA.MA .
CANADIAN JOURNAL OF CHEMISTRY, 1968, 46 (12) :2027-&