Calculation of electronic g-tensors for transition metal complexes using hybrid density functionals and atomic meanfield spin-orbit operators

2002 ◽  
Vol 23 (8) ◽  
pp. 794-803 ◽  
Author(s):  
Martin Kaupp ◽  
Roman Reviakine ◽  
Olga L. Malkina ◽  
Alexei Arbuznikov ◽  
Bernd Schimmelpfennig ◽  
...  
Keyword(s):  
Transition Metal ◽  
Metal Complexes ◽  
Transition Metal Complexes ◽  
Spin Orbit ◽  
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Influence of Electronic Spin and Spin–Orbit Coupling on Decoherence in Mononuclear Transition Metal Complexes

2014 ◽  
Vol 136 (21) ◽  
pp. 7623-7626 ◽  
Author(s):  
Michael J. Graham ◽  
Joseph M. Zadrozny ◽  
Muhandis Shiddiq ◽  
John S. Anderson ◽  
Majed S. Fataftah ◽  
...  
Keyword(s):  
Transition Metal ◽  
Metal Complexes ◽  
Transition Metal Complexes ◽  
Orbit Coupling ◽  
Spin Orbit Coupling ◽  
Spin Orbit ◽  
Electronic Spin

Assessment of higher-order spin–orbit effects on electronic g-tensors of d 1 transition-metal complexes by relativistic two- and four-component methods

2011 ◽  
Vol 129 (3-5) ◽  
pp. 715-725 ◽  
Author(s):  
Peter Hrobárik ◽  
Michal Repiský ◽  
Stanislav Komorovský ◽  
Veronika Hrobáriková ◽  
Martin Kaupp
Keyword(s):  
Transition Metal ◽  
Metal Complexes ◽  
Transition Metal Complexes ◽  
Higher Order ◽  
Spin Orbit
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