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Nayana Devaraj

Publications and source records attributed to Nayana Devaraj.

7 recordsLinked to original sources

Altermagnetism from the viewpoint of chemistry

Magnetism has been a central theme of research in chemistry, physics, and materials science, with chemical composition and bonding playing key roles in determining magnetic behavior. Altermagnets are a newly identified class of magnetic materials that combine features of conventional ferromagnets and antiferromagnets, arising from specific symmetry and electronic structure motifs. In this review, we present a chemistry-driven viewpoint on altermagnetism, highlighting how crystal chemistry, bonding, and electronic structure enable this unconventional magnetic order. We begin by introducing the fundamental concepts required to understand altermagnets, with an emphasis on symmetry considerations, orbital character, and electronic structure signatures. We then survey the diverse material families in which altermagnetism has been identified, drawing attention to coordination environments and structure-property relationships that favor altermagnetic order. We subsequently present experimental approaches which are useful for the characterization of altermagnetic materials. We examine ab initio materials discovery as a promising strategy for identifying new altermagnets, emphasizing how chemical constraints, such as symmetry and bonding, can guide computational searches. Other than their intrinsic importance, altermagnets provide interesting possibilities for technology. For this reason, we highlight possible applications that may be enabled through altermagnetic materials, along with their coupling with existing orders such as ferroelectricity and superconductivity. In conclusion, we point out some challenges and prospects, where chemically-based design guidelines can play an important role towards advancing altermagnetism research. In summary, this review offers an account of recent developments in altermagnetism, from basic concepts to the current state-of-the-art.

cond-mat.mtrl-sci↗

Transport Evidence of Magnetic Polarization in the Altermagnetic Candidate MnTe

The ability to precisely control magnetic properties is central to the development of future spin-based electronics. In this work, we report the successful growth of epitaxial α-MnTe thin films on InP(111) substrates using molecular beam epitaxy. Magneto-transport measurements at low temperatures reveal a distinct, hysteretic butterfly longitudinal magnetoresistance alongside a nonlinear transverse magneto-resistance response, suggesting the presence of a finite net magnetic polarization in the films. To understand the origin of this behavior, density functional theory (DFT) calculations were performed. While pristine bulk MnTe is a compensated antiferromagnet, our computational results suggest multiple pathways through which a finite magnetization can emerge in thin-film geometries, including interface-induced symmetry breaking and point defects. These findings demonstrate an epitaxial route for engineering magnetic responses in thin films.

cond-mat.mtrl-sci↗

Unlocking Doping Effects on Altermagnetism in MnTe: Emergence of Quasi-altermagnetism

Governed by specific symmetries, altermagnetism is an emerging field in condensed matter physics, characterized by unique spin-splitting of the bands in the momentum space co-existing with the compensated magnetization as in antiferromagnets. As crystals can have tailored and unintended defects, it is important to gain insights on how altermagnets are affected by the defects-driven symmetry-breaking which, in turn, can build promising perspectives on potential applications. In this study, considering the widely investigated MnTe as a prototype altermagnet, defects are introduced through substitutional doping to create a large configuration space of spin space groups. With the aid of density functional theory calculations, symmetry analysis, and model studies in this configuration space, we demonstrate the generic presence of spin-split of the antiferromagnetic bands in the momentum space. This is indicative of a wider class of quasi-altermagnetic materials, augmenting the set of ideal altermagnetic systems. Furthermore, we show that while pristine MnTe does not show anomalous Hall conductivity (AHC) with out-of-plane magnetization, suitable doping can be carried out to obtain finite and varied AHC. Our predictions of quasi-altermagnetism and doping-driven tailored AHC have the potential to open up as-yet-unexplored directions in this developing field.

cond-mat.mtrl-sci↗

Effect of symmetry breaking on altermagnetism in CrSb and Formation of fragmented nodal curves

Phenomena concerning altermagnets have opened up a window for unconventional analysis of the momentum space spin polarization (MSSP) of antiferromagnetic materials. Taking the example of one of the widely investigated altermagnets, CrSb, we explore the underlying mechanisms leading to the formation or breaking of altermagnetism. With the aid of DFT calculation and symmetry analysis, we study the behavior of MSSP in the altermagnetic bands of pristine CrSb, along with a few model structures designed from the pristine one by hypothetical vacancy engineering and interstitial doping. We show that the six-fold rotational symmetry of the pristine CrSb can be reduced to a two-fold rotational symmetry via vacancy and doping engineering. We discover the formation of fragmented nodal curves (FNCs) across the Brillouin zone when in an altermagnetic material when the symmetry is restricted to two-fold rotation. Unlike the typical nodal planes and axes, the location of the FNCs in the momentum space is found to be band-specific. The formation of FNCs is further validated by introducing uniaxial strain to CrSb and by examining the band structure of RbMnPO$_4$, as they both exhibit a two-fold rotational symmetry responsible for altermagnetism. We observe that, unlike the pristine case, these FNCs have the potential to manifest anomalous Hall conductivities (AHC), while the Néel vector orients along both in-plane and out-of-plane directions. This flexibility of the AHC will pave the way for the application of altermagnets in the futuristic quantum devices.

cond-mat.mtrl-sci↗

Extremely Large and Angle-Dependent Magnetoresistance in Kagome Dirac Semimetal RFe$_6$Sn$_6$ (R=Ho, Dy)

We report on the electronic, magnetic, and magneto-transport properties of Fe-based kagome Dirac system, RFe$_6$Sn$_6$ (R = Ho, Dy). Magnetic properties study reveals an antiferromagnetic order with N$\acute{e}$el temperature of $T_N \approx$ 570 K. Additionally, a weak ferromagnetic order emerge at low temperatures. Magnetotransport measurements demonstrate an extremely large magnetoresistance (XMR) reaching as high as $3\times 10^{3} \%$ for HoFe$_6$Sn$_6$ and $ 1\times 10^{3} \%$ for DyFe$_6$Sn$_6$ when measured at 2 K with 9 T of magnetic field. The semi-classical two-band model fitting of the Hall conductivity reveals nearly perfect electron-hole compensation and high carrier mobility, which leads to XMR behaviour in these system. Further, we identify large magnetoresistance anisotropy for the magnetic fields applied in different crystallographic orientations. In addition, considerable modification in the angle-dependent magnetoresistance (ADMR) pattern has been noticed between 2 and 50 K, indicating temperature-dependent changes in the Fermi surface topology of these systems.

cond-mat.mtrl-sci↗

Interplay of altermagnetism and pressure in hexagonal and orthorhombic MnTe

Alternative magnetic materials or ``altermagnets", characterized by their non-relativistic, momentum-dependent spin-split states, represent a cutting-edge advancement in the field of magnetism, offering promising avenues for spintronic applications. Among these materials, hexagonal MnTe has emerged as a standout material candidate for its substantial spin-splitting. In this study, employing first-principles electronic structure calculations and spin group symmetry analysis, we delve into the interplay of altermagnetism and pressure in two main phases of MnTe. Our relativistic calculations demonstrate the presence of tunable anomalous Hall effect (AHE) in hexagonal MnTe. In addition, our results underscore the pivotal role of pressure as a tuning parameter for the alternative magnetic traits in the system. Furthermore, we identify another phase of MnTe with orthorhombic structure, namely $γ$-MnTe, hosting altermagnetic characteristics. We study, in detail, its response in AHE and spin-spliting due to magnetization and pressure variations, respectively. Our study highlights the substantial impact of pressure on the properties of alternative magnetic materials, particularly emphasizing the pronounced tuning effect observed in the hexagonal and orthorhombic MnTe.

cond-mat.mtrl-sci↗

Theoretical investigation of quantum capacitance in the functionalized MoS$_2$-monolayer

In this work, we investigated the electronic structure and the quantum capacitance of the functionalized MoS$_2$ monolayer. The functionalizations have been done by using different ad-atom adsorption on Mo$S_2$ monolayer. Density functional theory calculations are performed to obtain an accurate electronic structure of ad-atom doped MoS$_2$ monolayer with a varying degree of doping concentration. The quantum capacitance of the systems was subsequently estimated. A marked quantum capacitance above 200 $μ$F/cm$^2$ has been observed. Our calculations show that the quantum capacitance of MoS$_2$ monolayer is significantly enhanced with substitutional doping of Mo with transition metal ad-atoms. The microscopic origin of such enhancement in quantum capacitance in this system has been analyzed. Our DFT-based calculation shows that generation of new electronic states at the proximity of the band-edge and the shift of Fermi level caused by the ad-atom adsorption results in a very high quantum capacitance in the system.

cond-mat.mtrl-sci↗