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Gayatri Panda

Publications and source records attributed to Gayatri Panda.

2 recordsLinked to original sources

Symmetry-Engineered Nonlinear Hall Response and Optical Response in Strained Monolayer Janus AsTeBr

The nonlinear Hall effect (NLHE) enables the generation of a transverse charge current in nonmagnetic materials with broken inversion symmetry while preserving time-reversal symmetry through the Berry curvature dipole (BCD). However, in crystals with $C_{3v}$ symmetry, the threefold rotational symmetry forces the BCD to vanish, thereby suppressing the intrinsic NLHE despite the presence of finite local Berry curvature. Here, using first-principles density functional theory combined with Wannier-based transport calculations, we demonstrate that uniaxial strain induces the NLHE in monolayer Janus AsTeBr by lowering the crystal symmetry from $C_{3v}$ to $C_{1}$ and generating a finite BCD. The resulting anisotropic redistribution of Berry-curvature hotspots produces pronounced nonlinear Hall conductivity and nonlinear Hall current, with the maximum response obtained at 2\% tensile strain. To elucidate the accompanying electronic-structure evolution, we further investigate the strain-dependent optical properties through the joint density of states, dielectric function, optical absorption, and reflectance. The optical spectra exhibit a systematic red shift and enhanced low-energy interband transitions, consistent with the strain-induced reconstruction of the electronic structure. Our results establish a microscopic connection between symmetry breaking, Berry-phase geometry, nonlinear Hall transport, and optical response, demonstrating that uniaxial strain provides an effective strategy for tailoring multiple functional properties in Janus two-dimensional materials.

cond-mat.mtrl-sci

Electric-Field and Doping-Induced Non collinear Magnetic Interactions in Monolayer Ti$_2$Si

Two-dimensional (2D) silicides are an emerging class of materials whose magnetic and relativistic properties remain largely unexplored. Using first-principles calculations, we investigate how electric-field modulation and transition-metal doping influence the magnetic exchange, magnetocrystalline anisotropy, and antisymmetric Dzyaloshinskii-Moriya interaction (DMI) in monolayer Ti2Si. Pristine Ti2Si is a dynamically stable ferromagnetic metal with in-plane anisotropy and centrosymmetric bonding, which suppresses DMI even under strong perpendicular electric fields. To overcome this symmetry constraint, we introduce Pt and Co substitution at Ti sites. Co enhances the magnetic exchange, whereas Pt provides strong spin orbit coupling (SOC), and the combined chemical asymmetry breaks inversion symmetry sufficiently to induce a sizable DMI. A Wannier-based tight-binding model captures the orbital-resolved superexchange pathways and reveals a clear hierarchy between a weak Si-mediated channel and a dominant Pt-mediated interlayer channel. First-principles calculations confirm that the Pt-assisted pathway governs the magnitude and sign of the total DMI. Among all configurations, Pt0.5CoTi0.5Si exhibits the strongest chiral interaction, with its intralayer and interlayer contributions favoring opposite rotation senses, namely counterclockwise (CCW) and clockwise (CW). Our results establish chemically engineered Ti2Si monolayers as a promising platform for realizing and tuning chiral magnetic textures in 2D silicides.

cond-mat.mtrl-sci