arXiv subjects

Da-shuai Ma

Publications and source records attributed to Da-shuai Ma.

3 recordsLinked to original sources

arXiv2026

Floquet Spin-Antiferroelectricity in Collinear Antiferromagnets

Multiferroics combining magnetic and polar orders offer opportunities for optical control of spin and electric degrees of freedom. Here, using symmetry analysis and Floquet theory, we establish Floquet spin-antiferroelectricity coexisting with unconventional magnetism in periodically driven collinear antiferromagnets, qualifying it as an unconventional multiferroic. This driven phase supports compensated, spin-resolved in-plane electric polarizations perpendicular to the vertical rotation axis, which are strictly forbidden by crystalline symmetry in equilibrium. Using a tight-binding model, we elucidate how light polarization controls the emergence of polar order and spin responses. Moreover, first-principles-based Floquet calculations predict its realization in monolayer $\text{MnPS}_3$, identifying a realistic two-dimensional antiferromagnetic platform. These findings establish a nonequilibrium route to spin-antiferroelectricity beyond equilibrium symmetry constraints and connect Floquet engineering, unconventional magnetism, and multiferroicity through optical control of spin and polar degrees of freedom.

cond-mat.mtrl-sci↗

arXiv2024

Strain-driven phonon topological phase transition impedes thermal transport in titanium monoxide

Topological phonon states in crystalline materials have attracted significant research interests due to their importance for fundamental physical phenomena, yet their implication on phonon thermal transport remains largely unexplored. Here, we use density functional theory calculations and symmetry analyses to explore topological phonon phase transitions under uniaxial strains and their tuning effects on thermal transport in titanium monoxide (TiO). Our calculation shows that application of 10% tension significantly diminishes lattice thermal conductivity of TiO by 77% and 66% along the a and c axes, respectively, at room temperature. This suppression is found to result largely from the breaking of symmetry protected degeneracy of acoustic branches, which induces a substantial enhancement of phonon scattering phase space due to the easier fulfillment of scattering selection rules. Our study provides evidence for the importance of phononic band topology in modulating thermal conductivity and offers a promising route towards controlling solid-state heat transport.

physics.comp-ph↗

arXiv2023

Design monolayer iodinenes based on halogen bond and tiling theory

Xenes, two-dimensional (2D) monolayers composed of a single element, with graphene as a typical representative, have attracted widespread attention. Most of the previous Xenes, X from group-IIIA to group-VIA elements have bonding characteristics of covalent bonds. In this work, we for the first time unveil the pivotal role of a halogen bond, which is a distinctive type of bonding with interaction strength between that of a covalent bond and a van der Waals interaction, in 2D group-VIIA monolayers. Combing the ingenious non-edge-to-edge tiling theory and state-of-art ab initio method with refined local density functional M06-L, we provide a precise and effective bottom-up construction of 2D iodine monolayer sheets, iodinenes, primarily governed by halogen bonds, and successfully design a category of stable iodinenes, encompassing herringbone, Pythagorean, gyrated truncated hexagonal, i.e. diatomic-kagome, and gyrated hexagonal tiling pattern. These iodinene structures exhibit a wealth of properties, such as flat bands, nontrivial topology, and fascinating optical characteristics, offering valuable insights and guidance for future experimental investigations. Our work not only unveils the unexplored halogen bonding mechanism in 2D materials but also opens a new avenue for designing other non-covalent bonding 2D materials.

cond-mat.mtrl-sci↗