The Jahn–Teller effect in the lower electronic states of benzene cation. I. Calculation of linear parameters for the e2g modes

2002 ◽  
Vol 117 (22) ◽  
pp. 9991-10000 ◽  
Author(s):  
Philip M. Johnson
Keyword(s):  
Electronic States ◽  
Teller Effect ◽  
Jahn Teller ◽  
Jahn Teller Effect

Cooperative Pseudo Jahn-Teller Effect as Microscopic Mechanism of (OMT)-(LTT) Structural Phase Transition in La2−xBaxCuO4Superconductors

1992 ◽  
Vol 291 ◽  
Author(s):  
Michael D. Kaplan
Keyword(s):  
Phase Transition ◽  
Structural Phase Transition ◽  
Structural Phase ◽  
Electronic States ◽  
Teller Effect ◽  
Excited Electronic States ◽  
Microscopic Mechanism ◽  
Jahn Teller ◽  
Jahn Teller Effect ◽  
Local Distortions

ABSTRACTA microscopic mechanism for the structural phase transition from the orthorhombic mediate temperature (OMT) phase into the low temperature tetragonal (LTT) one is suggested on the basis of the cooperative pseudo Jahn-Teller effect. The local distortions mixing the ground and the first excited electronic states are ordered antiferrodistortively and are connected in part, with the oxygen octahedra rotations around the [100] axis. The results are in agreement, with the neutron scattering experiments data.

scholarly journals The Jahn–Teller effect in the presence of partial isotopic substitution: the B̃1E′′ state of NH2D and NHD2

2015 ◽  
Vol 17 (21) ◽  
pp. 14145-14158 ◽  
Author(s):  
Ashim Kumar Saha ◽  
Gautam Sarma ◽  
Chung-Hsin Yang ◽  
Sebastiaan Y. T. van de Meerakker ◽  
David H. Parker ◽  
...  
Keyword(s):  
Force Field ◽  
Field Model ◽  
Electronic States ◽  
Teller Effect ◽  
Isotopic Substitution ◽  
Quadratic Force Field ◽  
Jahn Teller ◽  
Jahn Teller Effect

A simple linear and quadratic force field model for the lifting of the degeneracy on asymmetric isotopic substitution in degenerate electronic states subject to a weak Jahn–Teller effect.

The Jahn–Teller effect in the lower electronic states of benzene cation. III. The ground-state vibrations of C6H6+ and C6D6+

2004 ◽  
Vol 120 (18) ◽  
pp. 8587-8599 ◽  
Author(s):  
Andrew B. Burrill ◽  
You K. Chung ◽  
Heather A. Mann ◽  
Philip M. Johnson
Keyword(s):  
Ground State ◽  
Electronic States ◽  
Teller Effect ◽  
Jahn Teller ◽  
Jahn Teller Effect
Sign in / Sign up

Export Citation Format

Share Document