Published January 1991 | Version v1
Journal article

Calculation of g-factor in ESR with EHMO method

  • 1. China Univ. of Science and Technology, Hefei, AH. Dept. of Modern Chemistry

Description

The g-factors of paramagnetic molecules have been calculated by means of wave functions and energy levels obtained with EHMO, and a subprogram designd for computation of the G-tensor. The results are in agreement with the experimental data

Additional details

Publishing Information

Journal Title
Chinese Journal of Atomic and Molecular Physics
Journal Volume
8
Journal Issue
1
Series
Chin. J. At. Mol. Phys.
Journal Page Range
1782-1786
ISSN
1000-0364
CODEN
YYFXE

INIS

Country of Publication
China
Country of Input or Organization
China
INIS RN
23033217
Subject category
S74: ATOMIC AND MOLECULAR PHYSICS;
Descriptors DEI
ALGORITHMS; COMPLEXES; ELECTRON SPIN RESONANCE; ENERGY LEVELS; G VALUE; GYROMAGNETIC RATIO; MOLECULES; TENSORS; WAVE FUNCTIONS
Descriptors DEC
FUNCTIONS; MAGNETIC RESONANCE; RESONANCE