THEORETICAL CALCULATION OF PROTON SCREENING CONSTANTS AND MAGNETIC ANISOTROPY FOR BENZENE MOLECULES BY ANTISYMMETRIC MOLECULAR ORBITAL METHODS

被引：7

作者：

CARALP, L

HOARAU, J

机构：

来源：

关键词：

D O I：

10.1051/jcp/1968652104

中图分类号：

Q5 [生物化学]; Q7 [分子生物学];

学科分类号：

071010 ; 081704 ;

摘要：

引用

页码：2104 / &

共 22 条

[1] Note on diamagnetic anisotropy and the method of molecular orbitals
Brooks, H
[J]. JOURNAL OF CHEMICAL PHYSICS, 1941, 9 (06) : 463 - 465
[2] Brooks H., 1940, J CHEM PHYS, V8, P939, DOI [10.1063/1.1750608, DOI 10.1063/1.1750608]
[3] CARALP L, 1963, J CHIM PHYS, V55, P884
[4] CARALP L, 1962, THESIS BORDEAUX
[5] POLYCENTRIC 2PPI ELECTRON REPULSION INTEGRALS FOR BENZENE MOLECULE
CIZEK, J
[J]. MOLECULAR PHYSICS, 1965, 10 (01) : 83 - &
[6] CIZEK J, 1963, MOL PHYS, V6, P20
[7] ATOMIC SCREENING CONSTANTS FROM SCF FUNCTIONS
CLEMENTI, E
RAIMONDI, DL
[J]. JOURNAL OF CHEMICAL PHYSICS, 1963, 38 (11) : 2686 - &
[8] FUJII S, 1951, B CHEM SOC JPN, V24, P242
[9] Goeppert-Mayer M, 1938, J CHEM PHYS, V6, P645, DOI 10.1063/1.1750138
[10] NON-EMPIRICAL CALCULATION OF THE DIAMAGNETIC ANISOTROPY OF BENZENE
ITOH, T
OHNO, K
YOSHIZUMI, H
[J]. JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN, 1955, 10 (02) : 103 - 107