Hyperfine structures and the field effects of IBr molecule in its rovibronic ground state

2021 ◽  
Author(s):  
Defu Wang ◽  
Xuping Shao ◽  
Yunxia Huang ◽  
Chuanliang Li ◽  
Xiaohua Yang
Keyword(s):  
Ground State ◽  
Field Effects ◽  
Hyperfine Structures

Theoretical Calculation of Hyperfine Structures and g-factors of Ground State of Mercuric Fluoride Molecule

2017 ◽  
Vol 37 (9) ◽  
pp. 0902001
Author(s):  
郝 美 Hao Mei ◽  
汪海玲 Wang Hailing ◽  
印建平 Yin Jianping
Keyword(s):  
Theoretical Calculation ◽  
Ground State ◽  
Hyperfine Structures ◽  
G Factors

Ferromagnetic and antiferromagnetic copper(ii) complexes: Counterplay between zero-field effects of the quartet ground state and intermolecular interactions

2011 ◽  
Vol 40 (31) ◽  
pp. 7946 ◽  
Author(s):  
Z. Boulsourani ◽  
V. Tangoulis ◽  
C. P. Raptopoulou ◽  
V. Psycharis ◽  
C. Dendrinou-Samara
Keyword(s):  
Intermolecular Interactions ◽  
Ground State ◽  
Zero Field ◽  
Field Effects

Energies, radial expectation values, hyperfine structures of the ground state and highly excited states for C and O2+

2020 ◽  
Vol 34 (20) ◽  
pp. 2050197
Author(s):  
Chao Chen
Keyword(s):  
Excited States ◽  
Ground State ◽  
Magnetic Coupling ◽  
Wave Functions ◽  
Coupling Constants ◽  
Future Research ◽  
Expectation Values ◽  
Radiative Transitions ◽  
Experimental Values ◽  
Hyperfine Structures

The Rayleigh–Ritz variational method with multiconfiguration interaction wave functions is used to calculate energies, radiative transitions and radial expectation values of the [Formula: see text] [Formula: see text] ground state and the [Formula: see text], [Formula: see text], [Formula: see text] highly excited states of C and [Formula: see text]. Hyperfine structure parameters and magnetic coupling constants of these states are also calculated in this work. The present calculations agree well with theoretical and experimental values available in the literature. Other data not reported in the literature are expected to offer valuable benchmarks for future research.

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