Cover Image

The Interplay Between Electron Localization, Magnetic Order, and Jahn-Teller Distortion that Dictates LiMnO$_2$ Phase Stability

Fuente: arXiv

Saved in:

Bibliographic Details
Main Authors:	Kam, Ronald L., Binci, Luca, Kaplan, Aaron D., Persson, Kristin A., Marzari, Nicola, Ceder, Gerbrand
Format:	Preprint
Published:	2024
Subjects:	Materials Science
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

Thermodynamic accessibility of Li-Mn-Ti-O cation disordered rock-salt phases
by: Kam, Ronald L., et al.
Published: (2026)

The type-I antiferromagnetic Weyl semimetal InMnTi$_2$
by: Grassano, Davide, et al.
Published: (2022)

Mechanisms of alkali ionic transport in amorphous oxyhalides solid state conductors
by: Binci, Luca, et al.
Published: (2026)

Voltage Mining for (De)lithiation-stabilized Cathodes and a Machine Learning Model for Li-ion Cathode Voltage
by: Li, Haoming Howard, et al.
Published: (2024)

Magnons from time-dependent density-functional perturbation theory and nonempirical Hubbard functionals
by: Binci, Luca, et al.
Published: (2024)

Cross-functional transferability in universal machine learning interatomic potentials
by: Huang, Xu, et al.
Published: (2025)

Crystal structure prediction with host-guided inpainting generation and foundation potentials
by: Zhong, Peichen, et al.
Published: (2025)

Jahn–Teller Distortions Induced by in situ Li Migration in λ‐MnO2 for Boosting Electrocatalytic Nitrogen Fixation
by: Zijian Gao, et al.
Published: (2024)

Jahn–Teller Distortions Induced by in situ Li Migration in λ‐MnO2 for Boosting Electrocatalytic Nitrogen Fixation
by: Zijian Gao, et al.
Published: (2024)

Jahn‐Teller Effect: Impact of Distortion on Oxygen Electrocatalysis
by: Ashish Gaur, et al.
Published: (2025)

Intrinsic Distortion against Jahn‐Teller Distortion: A New Paradigm for High‐Stability Na‐Ion Layered Mn‐Rich Oxide Cathodes
by: Junteng Jin, et al.
Published: (2025)

Intrinsic Distortion against Jahn‐Teller Distortion: A New Paradigm for High‐Stability Na‐Ion Layered Mn‐Rich Oxide Cathodes
by: Junteng Jin, et al.
Published: (2025)

Interplay of Jahn–Teller Distortion and Ionic Substitution: Probing Multifunctional Properties in Alkaline‐Earth Hole Doped DyMnO3 Multiferroics
by: Rahul Mitra, et al.
Published: (2025)

Thermal stability and heat capacity of the LiMnO 2 phase
by: Danilo Alencar de Abreu, et al.
Published: (2025)

Ion correlations explain kinetic selectivity in diffusion-limited solid state synthesis reactions
by: Karan, Vir, et al.
Published: (2025)

High Temperature Jahn-Teller Distortion and Short Range Order in CsCuCl$_3$
by: Pappas, Emma A., et al.
Published: (2026)

Cation‐Anion Coordination for Covalent Anchoring of Manganese Oxides to Stabilize Mn Ion Valence and Suppress Jahn‐Teller Distortion and Dissolution
by: Xiaojie Lu, et al.
Published: (2025)

Machine learning Hubbard parameters with equivariant neural networks
by: Uhrin, Martin, et al.
Published: (2024)

Mitigating Jahn–Teller Distortion in LiMn 0.4 Fe 0.6 PO 4 via Hafnium Doping for Enhanced High‐Voltage Cycling Stability
by: Peng Wei, et al.
Published: (2026)

Comparative study of magnetic exchange parameters and magnon dispersions in NiO and MnO from first principles
by: Santos, Flaviano José dos, et al.
Published: (2025)

Li+/H+ exchange in solid-state oxide Li-ion conductors
by: Li, Zhuohan, et al.
Published: (2025)

Machine Learning the order-disorder Jahn-Teller transition in LaMnO$_3$
by: Celiberti, Lorenzo, et al.
Published: (2026)

Jahn-Teller-like Distortion in a One-dimensional π-Conjugated Polymer
by: Wang, Ziyi, et al.
Published: (2025)

Potential‐Window Engineering Tames Jahn–Teller Distortion in MnO 2 for Ultra‐Stable Aqueous Energy Storage
by: Xiaosha Cui, et al.
Published: (2025)

Cover Feature: Ab Initio Benchmarking on Unsupported and Coronene‐Supported Silver Atomic Clusters: Interplay Between Jahn–Teller Distortions and Fluxionality (Small Struct. 2/2026)
by: Katarzyna M. Krupka, et al.
Published: (2026)

LiCr x Fe y Mn 2− x − y − z Ti z O 4 Spinels as Cathodes for Li‐Ion Batteries: A Multidoping Approach to Suppress Jahn–Teller Distortion
by: Daniele Callegari, et al.
Published: (2026)

A Foundational Potential Energy Surface Dataset for Materials
by: Kaplan, Aaron D., et al.
Published: (2025)

Introducing Jahn‐Teller Distortion in Inorganic Solid‐State Electrolytes to Improve Ionic Conductivity
by: Xiaolong Xu, et al.
Published: (2026)

Harnessing Jahn‐Teller Distortion via Cation Disorder Engineering for Broadband Solar Absorptance
by: Yan Zheng, et al.
Published: (2025)

Engineering the diphasic Li‐rich Mn‐based composite with alleviated Jahn–Teller effect for high‐energy Li‐ion batteries
by: Feng Li, et al.
Published: (2025)

Achieving Ultrahigh Cycling Stability of LiMn 0.5 Fe 0.5 PO 4 Through Oxygen Vacancy with Jahn‐Teller Distortion Accommodation Induced by B‐Doping at P‐site
by: Zhen Li, et al.
Published: (2025)

V‐Induced Low‐Spin State Mn 3+ Suppresses Jahn–Teller Distortion for High‐Performance Aqueous Zinc Ion Batteries
by: Jin Ma, et al.
Published: (2025)

V‐Induced Low‐Spin State Mn 3+ Suppresses Jahn–Teller Distortion for High‐Performance Aqueous Zinc Ion Batteries
by: Jin Ma, et al.
Published: (2025)

Thermal Stress Synergizes Oxygen Vacancies Alleviate Jahn–Teller Distortion in Lithium Manganate Cathode
by: Hongjian Yang, et al.
Published: (2025)

Degradation Mechanism of Phosphate‐Based Li‐NASICON Conductors in Alkaline Environment
by: Benjamin X. Lam, et al.
Published: (2024)

Mitigating Long Range Jahn‐Teller Ordering to Stabilize Mn Redox Reaction in Biphasic Layered Sodium Oxide
by: Shihao Li, et al.
Published: (2024)

Spin-orbital Jahn-Teller bipolarons
by: Celiberti, Lorenzo, et al.
Published: (2023)

Suppressing Second‐Order Jahn–Teller Distortion in VO 2 (B): A Dissolution‐Resistant Electrode for Durable Aqueous Energy Storage
by: Minghui Gu, et al.
Published: (2025)

Modeling phase transformations in Mn-rich disordered rocksalt cathodes with machine learning interatomic potentials
by: Zhong, Peichen, et al.
Published: (2025)

Orbital‐Level Electronic Modulation of MnO 2 via Interfacial Built‐In Electric Fields: Breaking the Jahn–Teller Distortion Cycle for Ultra‐Durable Hybrid Capacitive Deionization
by: Xiaoke Li, et al.
Published: (2025)