A. T. Lee

collaborators

3 papers

cond-mat.mtrl-sci2026

Revealing Short- and Long-range Li-ion diffusion in Li $_{2}$ MnO $_{3}$ from finite-temperature dynamical mean field theory

Alex Taekyung Lee, Kristin A. Persson, Anh T. Ngo

Li $_{2}$ MnO $_{3}$ is a key component of Li-excess layered cathodes of the form $(1 - x), LiM O_{2} + x, L i_{2} Mn O_{3}$ ( $M$ = Mn, Ni, Co, \dots), yet its role in setting Li-ion…

cond-mat.str-el2025

Impact of structural distortions on the correlated electronic structure of orbital-selective Mott insulating Na $_{3}$ Co $_{2}$ SbO $_{6}$ under strains

Nam Nguyen, Alex Taekyung Lee, Anh T. Ngo +1

Na $_{3}$ Co $_{2}$ SbO $_{6}$ is a promising candidate to realize the Kitaev spin liquid phase since the large Kitaev spin exchange interaction is tunable via the change in electronic st…

cond-mat.str-el2025

First-principle Study of Multiple Metastable Charge Ordering States in La $_{1/3}$ Sr $_{2/3}$ FeO $_{3}$

Nam Nguyen, Alex Taekyung Lee, Vijay Singh +2

La doped SrFeO $_{3}$ , La $_{1/3}$ Sr $_{2/3}$ FeO $_{3}$ , exhibits a metal-to-insulator transition accompanied by both antiferromagnetic and charge ordering states along with the Fe-O b…

Revealing Short- and Long-range Li-ion diffusion in Li2​MnO3​ from finite-temperature dynamical mean field theory

Impact of structural distortions on the correlated electronic structure of orbital-selective Mott insulating Na3​Co2​SbO6​ under strains

First-principle Study of Multiple Metastable Charge Ordering States in La1/3​Sr2/3​FeO3​

Revealing Short- and Long-range Li-ion diffusion in Li $_{2}$ MnO $_{3}$ from finite-temperature dynamical mean field theory

Impact of structural distortions on the correlated electronic structure of orbital-selective Mott insulating Na $_{3}$ Co $_{2}$ SbO $_{6}$ under strains

First-principle Study of Multiple Metastable Charge Ordering States in La $_{1/3}$ Sr $_{2/3}$ FeO $_{3}$