Related papers: Spin Models and Cluster Multipole Method: Applicat…
The coupled cluster method (CCM) is employed to very high orders of approximation to study the ground-state (GS) properties of the spin-$s$ Heisenberg antiferromagnet (with isotropic interactions, all of equal strength, between…
Accurate modeling of spin-orbit coupling and noncollinear magnetism requires noncollinear density functionals within the two-component generalized Kohn-Sham (GKS) framework, yet constructing and implementing noncollinear functionals remains…
We propose a new approach to the measurement of a single spin state, based on nuclear magnetic resonance (NMR) techniques and inspired by the coherent control over many-body systems envisaged by Quantum Information Processing (QIP). A…
We develop a structured theoretical framework used in our recent articles [Eur. Phys. J. B 92, 93 (2019) and Phys. Rev. B 101, 094427 (2020)] to characterize the unusual behavior of the magnetic spectrum, magnetization and magnetic…
We present an innovative cluster-based method employing linear combinations of diverse cluster mean-field (cMF) states, and apply it to describe the ground state of strongly-correlated spin systems. In cluster mean-field theory, the ground…
Noncoplanar magnetic states with a scalar spin chirality have been intensively studied in condensed matter physics, since they exhibit fascinating physical phenomena. We theoretically propose the generation of such noncoplanar magnetic…
We propose an approach for low-dimensional visualisation and classification of complex topological magnetic structures formed in magnetic materials. Within the approach one converts a three-dimensional magnetic configuration to a vector…
We propose a non-collinear spin-constrained method that generates training data for deep-learning-based magnetic model, which provides a powerful tool for studying complex magnetic phenomena that requires large-scale simulations at the…
Cluster states are versatile quantum resources and an essential building block for measurement-based quantum computing. The possibility to generate cluster states in specific systems may thus serve as an indicator regarding if and to what…
It is shown that site disorder induces noncoplanar states, competing with the thermal selection of coplanar states, in the nearest neighbor, classical kagome Heisenberg antiferromagnet (AFM). For weak disorder, it is found that the ground…
We developed a technique to determine suitable spin models for small embedded clusters of arbitrary geometry by combining the spin-cluster expansion with the relativistic disordered local moment scheme. We present results for uncovered and…
We present combined spin model and first principles electronic structure calculations to study the weak ferromagnetism in bulk Mn$_3$Z (Z=Sn, Ge, Ga) compounds. The spin model parameters were determined from a spin-cluster expansion…
In recent years, the concept of multipoles has been widely used to describe and classify various magnetic and electric responses in solids, providing a systematic way to identify symmetry-allowed or -forbidden physical responses.…
We introduce a multi-configurational approach to study the magneto-structural correlations in $3d^2$ systems. The theoretical framework represents a restricted active space self-consistent field method, with active space optimized to the…
We have investigated the dynamical magnetic properties of the V-based kagome stibnite compounds by combining the ab-initio calculated magnetic parameters of a spin Hamiltonian like inter-site exchange parameters, magnetocrystalline…
Using a pure electric current to control kagome noncollinear antiferromagnets is promising in information storage and processing, but a full description is still lacking, in particular, on intrinsic (i.e., no external magnetic fields or…
We report results from spin trimer-based cluster quantum Monte Carlo simulations for the thermodynamic properties of two-dimensional frustrated quantum antiferromagnets that are composed of weakly-coupled three-spin (trimer) clusters. In…
In recent years, a better understanding of the Monte Carlo method has provided us with many new techniques in different areas of statistical physics. Of particular interest are so called cluster methods, which exploit the considerable…
An effective spin-orbit Hamiltonian is derived for a spin-1/2 trimerized kagome antiferromagnet in the second-order of perturbation theory in the ratio of two coupling constants. Low-energy singlet states of the obtained model are mapped to…
We investigate the spin dynamics of the non-collinear kagome triangular anti-ferromagnet Mn$_3$Rh using linear response time-dependent density functional theory. To this end, we present a novel first principles computational scheme for the…