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Mapping the magnetic exchange interactions from model Hamiltonian to density functional theory is a crucial step in multi-scale modeling calculations. Considering the usual magnetic force theorem but with arbitrary rotational angles of the…

Materials Science · Physics 2010-11-23 Samir Lounis , Peter H. Dederichs

We show that atoms trapped in micro-cavities that interact via exchange of virtual photons can model an anisotropic Heisenberg spin-1/2 chain in an external magnetic field. All parameters of the effective Hamiltonian can individually be…

Quantum Physics · Physics 2009-11-13 Michael J. Hartmann , Fernando G. S. L. Brandao , Martin B. Plenio

We report first-principles all-electron density-functional based studies of the electronic structure, magnetic ordering and anisotropy for the V$_{15}$ molecular magnet. From these calculations, we determine a Heisenberg Hamiltonian with…

Materials Science · Physics 2009-11-07 Jens Kortus , C. Stephen Hellberg , Mark R. Pederson

The Kitaev model with an applied magnetic field in the $H||[111]$ direction shows two transitions: from a non-abelian gapped quantum spin liquid (QSL) to a gapless QSL at $H_{c1} \simeq 0.2K$ and a second transition at a higher field…

Strongly Correlated Electrons · Physics 2019-06-11 Niravkumar D. Patel , Nandini Trivedi

We present a thorough experimental study of the three-dimensional hyperhoneycomb Kitaev magnet $\beta$-Li$_2$IrO$_3$, using a combination of inelastic neutron scattering (INS), time-domain THz spectroscopy, and heat capacity measurements.…

The magnetic insulator $\alpha$-RuCl$_{3}$ is a promising candidate to realize Kitaev interactions on a quasi-2D honeycomb lattice. We perform extensive susceptibility measurements on single crystals of $\alpha$-RuCl$_{3}$, including…

I propose the emergence of the spin-orbital-coupled vector chirality in a non-frustrated Mott insulator with the strong spin-orbit coupling due to $ab$-plane's inversion-symmetry (IS) breaking. I derive the superexchange interactions for a…

Strongly Correlated Electrons · Physics 2016-11-10 Naoya Arakawa

We study a $\mathbb{Z}_3$ Kitaev model on the honeycomb lattice with nearest neighbor interactions. Based on matrix product state simulations and symmetry considerations, we find evidence that, with ferromagnetic isotropic couplings, the…

Strongly Correlated Electrons · Physics 2024-04-29 Li-Mei Chen , Tyler D. Ellison , Meng Cheng , Peng Ye , Ji-Yao Chen

A spin model of quasi-one dimensional LiCu$_{2}$O$_{2}$ compound with ground state of ellipsoidal helical structure in which the helical axis is along the diagonal of CuO$_{4}$ squares has been adopted. By taking into account the interchain…

Materials Science · Physics 2015-06-18 Yan Qi , An Du

Type-II multiferroics, in which the magnetic order breaks inversion symmetry, are appealing for both fundamental and applied research due their intrinsic coupling between magnetic and electrical orders. Using first-principles calculations…

Materials Science · Physics 2023-11-20 Urmimala Dey , Mark S. Senn , Nicholas C. Bristowe

The spin-driven polarizations of type-I multiferroics are veiled by the preexisting ferroelectric (FE) polarization. Using first-principles calculations combined with a spin model, we uncover two hidden but huge spin-driven polarizations in…

Strongly Correlated Electrons · Physics 2015-04-28 Jun Hee Lee , Randy S. Fishman

The quest for quantum spin liquids has garnered significant attention due to their rich physics and disruptive prospects in quantum communication and computation. Spin-orbit coupling, electron correlation, and structural distortion play…

Strongly Correlated Electrons · Physics 2024-12-24 Deepak K Roy , Mukul Kabir

This article investigates Neel-type states in the anisotropic Heisenberg model with an external field. For arbitrary spin $s$ and arbitrary dimension of the space $d$ we find the expressions relating the angles which define the directions…

Quantum Physics · Physics 2025-07-17 Pavel Babaian , Gennady Koval

We consider a half-filled system of spin-1/2 fermions on a triangular ladder with spin-dependent hopping in the presence of spin-dependent flux. Using the Schrieffer-Wolff transformation, we derive an effective spin Hamiltonian describing…

Strongly Correlated Electrons · Physics 2026-03-11 Shota Garuchava , Bachana Beradze , Tatia Sharia , George I. Japaridze

We develop an exactly solvable model with Kitaev-type interactions and study its phase diagram on the dual lattice of the quasicrystalline Ammann-Beenker lattice. Our construction is based on the $\Gamma$-matrix generalization of the Kitaev…

Strongly Correlated Electrons · Physics 2024-11-05 M. A. Keskiner , O. Erten , M. Ö. Oktel

Kitaev's honeycomb-lattice spin-$1/2$ model has become a paradigmatic example for $\mathbb{Z}_2$ quantum spin liquids, both gapped and gapless. Here we study the fate of these spin-liquid phases in differently stacked bilayer versions of…

Strongly Correlated Electrons · Physics 2018-10-03 Urban F. P. Seifert , Julian Gritsch , Erik Wagner , Darshan G. Joshi , Wolfram Brenig , Matthias Vojta , Kai P. Schmidt

We derive a Hamiltonian structure for the $N$-particle hyperbolic spin Ruijsenaars-Schneider model by means of Poisson reduction of a suitable initial phase space. This phase space is realised as the direct product of the Heisenberg double…

High Energy Physics - Theory · Physics 2019-08-22 Gleb Arutyunov , Enrico Olivucci

We propose a family of layered quantum spin-orbital models as a platform to study fractionalization, unconventional forms of symmetry-breaking order, and their possible coexistence. The models are built by stacking $N$ layers of a…

Strongly Correlated Electrons · Physics 2026-05-25 Pedro M. Cônsoli , Aayush Vijayvargia , Onur Erten

We propose a method to determine the magnetic exchange interaction and on-site anisotropy tensors of extended Heisenberg spin models from density functional theory including relativistic effects. The method is based on the…

Motivated by the magnetically-driven high-temperature ferroelectric behavior of CuO and the subsequent theoretical efforts to understand this intriguing phenomenon, we study a spin model on a two-dimensional square lattice which possesses…

Strongly Correlated Electrons · Physics 2015-06-17 Kanika Pasrija , Sanjeev Kumar