Topological quantum matter to topological phase conversion: Fundamentals, materials, physical systems for phase conversions, and device applications

MMH Polash, S Yalameha, H Zhou, K Ahadi… - Materials Science and …, 2021 - Elsevier
The spin-orbit coupling field, an atomic magnetic field inside a Kramers' system, or discrete
symmetries can create a topological torus in the Brillouin Zone and provide protected edge …

Ab Initio Simulations and Materials Chemistry in the Age of Big Data

GR Schleder, ACM Padilha… - Journal of chemical …, 2019 - ACS Publications
In this perspective, we discuss computational advances in the last decades, both in
algorithms as well as in technologies, that enabled the development, widespread use, and …

Theoretical evidence of the spin–valley coupling and valley polarization in two-dimensional MoSi 2 X 4 (X= N, P, and As)

H Ai, D Liu, J Geng, S Wang, KH Lo… - Physical Chemistry …, 2021 - pubs.rsc.org
Very recently, the centimeter-scale MoSi2N4 monolayer was synthesized experimentally
and exhibited a semiconducting nature with high mobility (Hong et al., Science, 2020, 369 …

Different shapes of spin textures as a journey through the Brillouin zone

C Mera Acosta, L Yuan, GM Dalpian, A Zunger - Physical Review B, 2021 - APS
Crystallographic point group symmetry (CPGS) such as polar and nonpolar crystal classes
have long been known to classify compounds that have spin-orbit-induced spin splitting …

Unconventional spin textures emerging from a universal symmetry theory of spin-momentum locking

Y Liu, J Li, P Liu, Q Liu - npj Quantum Materials, 2024 - nature.com
Spin textures, ie, the distribution of spin polarization vectors in reciprocal space, exhibit
diverse patterns determined by symmetry constraints, resulting in a variety of spintronic …

Two-dimensional spin-valley locking spin valve

LL Tao, EY Tsymbal - Physical Review B, 2019 - APS
Valleytronics is an emerging field of research which employs energy valleys in the band
structure of two-dimensional (2D) electronic materials to encode information. A special …

The Rashba scale: Emergence of band anti-crossing as a design principle for materials with large Rashba coefficient

CM Acosta, E Ogoshi, A Fazzio, GM Dalpian, A Zunger - Matter, 2020 - cell.com
The spin-orbit-induced spin splitting of energy bands in low-symmetry compounds (the
Rashba effect) has a long-standing relevance to spintronic applications and the fundamental …

Quasiparticle band structures, spontaneous polarization, and spin-splitting in noncentrosymmetric few-layer and bulk γ-GeSe

H Kim, HJ Choi - Journal of Materials Chemistry C, 2021 - pubs.rsc.org
Group-IV monochalcogenides have attracted much attention due to their potential of
ferroelectric and multiferroic properties. Recently, centrosymmetric γ-phase GeSe in a …

Nitrogen vacancies in monolayer WSi2N4 for hydrogen evolution reaction: A first-principles study

S Zhang, JH Choi - Surface Science, 2024 - Elsevier
The recent synthesis of two-dimensional layered WSi 2 N 4 has attracted considerable
attention owing to its potential applications in diverse fields. In this study, we use first …

Rashba-like spin splitting around non-time-reversal-invariant momenta

LL Tao, J Li, Y Liu, X Wang, Y Sui, B Song… - Physical Review B, 2023 - APS
The ubiquitous Rashba spin splitting occurring around time-reversal-invariant momenta
(TRIM) reflects the fundamental interplay between spin-orbit coupling (SOC) and crystalline …