Geometric simulation of perovskite frameworks with Jahn-Teller distortions: applications to the cubic manganites.

Geometric simulation of perovskite frameworks with Jahn-Teller distortions: applications to the cubic manganites.

A new approach is presented for modeling perovskite frameworks with disordered Jahn-Teller (JT) distortions and has been applied to study the elastic response of the LaMnO3 structure to defects in the JT ordering. Surprisingly, antiphase domain boundary defects in the pattern of ordered JT octahedra...

Full description

Bibliographic Details
Main Authors:	Sartbaeva, A, Wells, SA, Thorpe, M, Bozin, E, Billinge, S
Format:	Journal article
Language:	English
Published:	2006

Similar Items

Understanding the insulating phase in colossal magnetoresistance manganites: shortening of the Jahn-Teller long-bond across the phase diagram of La1-xCaxMnO3.
by: Bozin, E, et al.
Published: (2007)

Understanding the insulating phase in CMR manganites: Shortening of the Jahn-Teller long-bond across the phase diagram of La_{1-x} Ca_x Mn O_3
by: Bozin, E, et al.
Published: (2006)

Understanding the insulating phase in colossal magnetoresistance manganites: Shortening of the Jahn-Teller long-bond across the phase diagram of La1-xCaxMnO3
by: Bozin, E, et al.
Published: (2007)

Cooperative Jahn-Teller Distortion in PrO2
by: Gardiner, C, et al.
Published: (2003)

Jahn-Teller distortion driven magnetic polarons in magnetite
by: H. Y. Huang, et al.
Published: (2017-06-01)

Contribution of Jahn-Teller and charge transfer excitations to the photovoltaic effect of manganite/titanite heterojunctions
by: Benedikt Ifland, et al.
Published: (2017-01-01)

The Jahn-Teller distortion and cation ordering in the perovskite Sr2MnSbO6
by: Cheah, M, et al.
Published: (2006)

Quadrupolar ordering in LaMnO3 revealed from scattering data and geometric modeling.
by: Sartbaeva, A, et al.
Published: (2007)

Chiral Jahn–Teller Distortion in Quasi-Planar Boron Clusters
by: Dongbo Zhao, et al.
Published: (2024-04-01)

The Jahn-Teller Distortion at High Pressure: The Case of Copper Difluoride
by: Dominik Kurzydłowski
Published: (2018-03-01)

Jahn–Teller Magnets
by: Alexander Moskvin
Published: (2023-11-01)

JAHN-TELLER DISTORTION OF THE ELECTRON-DENSITY IN ALPHA-NICKEL SULFATE HEXAHYDRATE
by: Hester, J, et al.
Published: (1993)

The phonon-modulated Jahn–Teller distortion of the nitrogen vacancy center in diamond
by: William P. Carbery, et al.
Published: (2024-10-01)

Jahn-Teller distortion in bis(terpyridine)nickel(III) – Elongation or compression?
by: Jeanet Conradie
Published: (2023-12-01)

Supercooled Jahn-Teller ice
by: Kota Mitsumoto, et al.
Published: (2022-08-01)

Magnetoelectricity in Jahn–Teller Elastics
by: Michael Kaplan
Published: (2021-06-01)

Superconductivity and the Jahn–Teller Polaron
by: Annette Bussmann-Holder, et al.
Published: (2022-01-01)

Utilizing total scattering to study the Jahn-Teller transition in La1-xCaxMnO3
by: Bozin, E, et al.
Published: (2007)

First-principles study of the dynamic Jahn-Teller distortion of the neutral vacancy in diamond
by: Prentice, JCA, et al.
Published: (2017)

Crystal Lattice-Induced Stress modulates Photoinduced Jahn–Teller Distortion Dynamics
by: Vandana Tiwari, et al.
Published: (2024-10-01)

Large piezoelectric response in a Jahn-Teller distorted molecular metal halide
by: Sasa Wang, et al.
Published: (2023-04-01)

STRUCTURAL DISTORTIONS OF COORDINATED KETENE MOLECULE INDUCED BY THE PSEUDO JAHN-TELLER EFFECT
by: Natalia Gorinchoy
Published: (2016-12-01)

The Jahn-Teller effect in icosahedral symmetry
by: Cullerne, J, et al.
Published: (1995)

Spin-orbital Jahn-Teller bipolarons
by: Lorenzo Celiberti, et al.
Published: (2024-03-01)

Calculation of the Jahn-Teller parameters with DFT
by: Zlatar Matija, et al.
Published: (2019-01-01)

Spiro-conjugated molecular junctions: between Jahn-Teller distortion and destructive quantum interference
by: Sowa, J, et al.
Published: (2018)

High-pressure behaviour of Prussian blue analogues: interplay of hydration, Jahn-Teller distortions and vacancies
by: Boström, HLB, et al.
Published: (2018)

Electronic Correlations, Jahn-Teller Distortions and Mott Transition to Superconductivity in Alkali-C60 Compounds
by: Alloul H.
Published: (2012-03-01)

Origins versus fingerprints of the Jahn-Teller effect in d-electron ABX_{3} perovskites
by: Julien Varignon, et al.
Published: (2019-11-01)

Template-Based Geometric Simulation of Flexible Frameworks
by: Wells, SA, et al.
Published: (2012)

Spin-orbit entanglement driven by the Jahn-Teller effect
by: Alejandro S. Miñarro, et al.
Published: (2024-10-01)

Valley Jahn-Teller Effect in Twisted Bilayer Graphene
by: M. Angeli, et al.
Published: (2019-10-01)

Quantifying Jahn-Teller distortion at the nanoscale with picometer accuracy using position averaged convergent beam electron diffraction
by: Binbin Wang, et al.
Published: (2019-12-01)

Jahn–Teller distortion in Sr2FeO4: group-theoretical analysis and hybrid DFT calculations
by: Guntars Zvejnieks, et al.
Published: (2023-09-01)

Perovskite Crystals: Unique Pseudo-Jahn–Teller Origin of Ferroelectricity, Multiferroicity, Permittivity, Flexoelectricity, and Polar Nanoregions
by: Isaac B. Bersuker, et al.
Published: (2020-11-01)

Displacive Jahn–Teller transition in NaNiO2
by: Nagle-Cocco, LAV, et al.
Published: (2024)

Ultrafast Jahn‐Teller Photoswitching in Cobalt Single‐Ion Magnets
by: Sophie E. Canton, et al.
Published: (2023-07-01)

Density Functional Theory for the Study of the Multimode Jahn-Teller Effect
by: Matija Zlatar, et al.
Published: (2010-03-01)

Jahn-Teller Effect and Spin-Orbit Coupling: Friends or Foes?
by: Sergey V. Streltsov, et al.
Published: (2020-08-01)

Local polarization in oxygen-deficient LaMnO_{3} induced by charge localization in the Jahn-Teller distorted structure
by: Chiara Ricca, et al.
Published: (2020-12-01)