Potential energy surfaces and Jahn-Teller effect on CH4⋯NO complexes

The topology of the lower energy sheet for the Potential Energy Surface corresponding to the dynamic Jahn-Teller effect is obtained by means of homological techniques.

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Jahn-Teller effect for short-lived states: Study of the complex potential energy surfaces

The Journal of Chemical Physics ◽

10.1063/1.1755651 ◽

2004 ◽

Vol 121 (1) ◽

pp. 5 ◽

Cited By ~ 7

Author(s):

Sven Feuerbacher ◽

Lorenz S. Cederbaum

Keyword(s):

Potential Energy ◽

Complex Potential ◽

Potential Energy Surfaces ◽

Teller Effect ◽

Jahn Teller ◽

Jahn Teller Effect ◽

Energy Surfaces

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Jahn-Teller Effect in the Emission of Kl:Tl-Type Phosphors; Coexistence of Two Kinds of Minima on theT1u3Adiabatic Potential-Energy Surfaces

Physical Review Letters ◽

10.1103/physrevlett.28.743 ◽

1972 ◽

Vol 28 (12) ◽

pp. 743-746 ◽

Cited By ~ 47

Author(s):

A. Ranfagni

Keyword(s):

Potential Energy ◽

Potential Energy Surfaces ◽

Teller Effect ◽

Jahn Teller ◽

Jahn Teller Effect ◽

Energy Surfaces

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Potential energy surfaces and tunneling dynamics of some Jahn-Teller active molecules

The Journal of Physical Chemistry ◽

10.1021/j100268a018 ◽

1985 ◽

Vol 89 (22) ◽

pp. 4739-4744 ◽

Cited By ~ 25

Author(s):

Michael J. S. Dewar ◽

Kenneth M. Merz

Keyword(s):

Potential Energy ◽

Potential Energy Surfaces ◽

Jahn Teller ◽

Tunneling Dynamics ◽

Energy Surfaces

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The first determination of the energy difference between solid-state conformers by x-ray diffraction. 1. The crystal structure of the pseudo-Jahn-Teller complex (nitrito)bis(2,2'-bipyridyl)copper(II) nitrate at 20, 100, 165 and 296 K and of its isostructural zinc(II) analog at 295 K. 2. The possibility of using x-ray diffraction to characterize adiabatic potential energy surfaces and relative ligand strengths

Journal of the American Chemical Society ◽

10.1021/ja00241a009 ◽

1987 ◽

Vol 109 (7) ◽

pp. 1947-1958 ◽

Cited By ~ 42

Author(s):

Charles J. Simmons ◽

Brian J. Hathaway ◽

Kitti Amornjarusiri ◽

Bernard D. Santarsiero ◽

Abraham Clearfield

Keyword(s):

Crystal Structure ◽

Solid State ◽

Potential Energy ◽

Potential Energy Surfaces ◽

Energy Difference ◽

X Ray Diffraction ◽

X Ray ◽

Jahn Teller ◽

Energy Surfaces

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High-order expansion of T2×t2 Jahn–Teller potential-energy surfaces in tetrahedral molecules

The Journal of Chemical Physics ◽

10.1063/1.3382912 ◽

2010 ◽

Vol 132 (15) ◽

pp. 154108 ◽

Cited By ~ 47

Author(s):

Daniel Opalka ◽

Wolfgang Domcke

Keyword(s):

Potential Energy ◽

Potential Energy Surfaces ◽

High Order ◽

Order Expansion ◽

Jahn Teller ◽

Tetrahedral Molecules ◽

Energy Surfaces ◽

High Order Expansion

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Renner–Teller effect in linear tetra-atomic molecules. I. Variational method including couplings between all degrees of freedom on six-dimensional potential energy surfaces

The Journal of Chemical Physics ◽

10.1063/1.3089354 ◽

2009 ◽

Vol 130 (13) ◽

pp. 134301 ◽

Cited By ~ 13

Author(s):

L. Jutier ◽

C. Léonard ◽

F. Gatti

Keyword(s):

Variational Method ◽

Potential Energy ◽

Potential Energy Surfaces ◽

Degrees Of Freedom ◽

Teller Effect ◽

Energy Surfaces

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High-order expansion of T2×e Jahn–Teller potential-energy surfaces in tetrahedral systems

Chemical Physics Letters ◽

10.1016/j.cplett.2010.06.011 ◽

2010 ◽

Vol 494 (4-6) ◽

pp. 134-138 ◽

Cited By ~ 24

Author(s):

Daniel Opalka ◽

Wolfgang Domcke

Keyword(s):

Potential Energy ◽

Potential Energy Surfaces ◽

High Order ◽

Order Expansion ◽

Jahn Teller ◽

Energy Surfaces ◽

High Order Expansion

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Jahn-Teller Effect on the Structure of the Emission Produced by Excitation in theABand of KI: Tl-Type Phosphors. Two Kinds of Minima on theΓ4−(T1u3)Adiabatic Potential-Energy Surface

Physical Review B ◽

10.1103/physrevb.1.4161 ◽

1970 ◽

Vol 1 (10) ◽

pp. 4161-4178 ◽

Cited By ~ 232

Author(s):

Atsuo Fukuda

Keyword(s):

Potential Energy ◽

Potential Energy Surface ◽

Energy Surface ◽

Adiabatic Potential ◽

Teller Effect ◽

Jahn Teller ◽

Jahn Teller Effect ◽

Adiabatic Potential Energy Surface

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Modeling cusps in adiabatic potential energy surfaces using a generalized Jahn-Teller coordinate

Chemical Physics Letters ◽

10.1016/j.cplett.2016.07.029 ◽

2016 ◽

Vol 660 ◽

pp. 55-59 ◽

Cited By ~ 8

Author(s):

B.R.L. Galvão ◽

V.C. Mota ◽

A.J.C. Varandas

Keyword(s):

Potential Energy ◽

Potential Energy Surfaces ◽

Adiabatic Potential ◽

Jahn Teller ◽

Energy Surfaces

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