相关论文: Implementation of Generalized Bloch Theorem Using …
We present a detailed theoretical study of effective spin-orbit coupling (SOC) Hamiltonians for graphene based systems, covering global effects such as proximity to substrates and local SOC effects resulting, for example, from dilute…
We develop an artificial neural network (ANN) approach to classify simulated signals corrsponding to the semi-classical description of Bloch oscillations in pristine graphene. After the ANN is properly trained, we consider the inverse…
We investigated the spiral spin density waves in the monolayer 1T-MnCl$_2$ for a set of spiral vectors based on first-principles calculations. The magnetic ground states were evaluated by means of the generalized Bloch theorem within the…
In this paper, a general hybrid fixed point theorem for the contractive mappings in generalized Banach spaces is proved via measure of weak non-compactness and it is further applied to fractional integral equations for proving the existence…
We show that a generalized Dirac structure survives beyond the linear regime of the low-energy dispersion relations of graphene. A generalized uncertainty principle of the kind compatible with specific quantum gravity scenarios with a…
Purpose: The paper introduces a classical model to describe the dynamics of large spin-1/2 ensembles associated with nuclei bound in large molecule structures, commonly referred to as the semi-solid spin pool, and their magnetization…
External non-uniform magnetic fields acting on molecules induce non-collinear spin-densities and spin-symmetry breaking. This necessitates a general two-component Pauli spinor representation. In this paper, we report the implementation of a…
Localized orbitals are important for modeling and interpreting complicated electronic structures of atoms and molecules in a chemically meaningful way. Here, we present the parameter-free procedure for transforming delocalized molecular…
It is common for dispersion curves of damped periodic materials to be based on real frequencies versus complex wavenumbers or, conversely, real wavenumbers versus complex frequencies. The former condition corresponds to harmonic wave motion…
We present a compact and general derivation of the generalized Bloch-Wangsness-Redfield kinetic equations for systems with the static spin Hamiltonian utilizing the concept of the Liouville space. We show that the assumptions of short…
A recent experimental breakthrough allowed to probe electronic parametric resonance of a single magnetic atom in an STM setup. The results present intriguing features, such as an asymmetric lineshape and unusually large ratio of the…
Through micromagnetic simulations, this work analyzes the stability of Bloch points in magnetic nanospheres and the possibility of using an array of such particles to compose a system with the features of a magnetic trap. We show that a BP…
The models of spin systems defined on Euclidean space provide powerful machinery for studying a broad range of condensed matter phenomena. While the non-relativistic effective description is sufficient for most of the applications, it is…
A scheme to calculate the electronic structure of systems having a spiral magnetic structure is presented. The approach is based on the KKR (Korringa-Kohn-Rostoker) Green's function formalism which allows in combination with CPA (Coherent…
An atomistic model based on the spin-restricted extended Huckel theory (EHT) is presented for simulating electronic structure and I-V characteristics of graphene devices. The model is applied to zigzag and armchair graphene nano-ribbons…
Establishing the conditions under which orbital, spin and lattice-pseudospin degrees of freedom are mutually coupled in realistic nonequilibrium conditions is a major goal in the emergent field of graphene spintronics. Here, we use…
We develop a comprehensive theory for the effective dynamics of Bloch electrons based on symmetry. We begin with a scheme to systematically derive the irreducible representations (IRs) characterizing the Bloch functions. Starting from a…
We propose a computational method that simplifies drastically the inclusion of spin-orbit interaction in density functional theory implemented on localised atomic orbital basis sets. Our method is based on a well-known procedure for…
We present an ab initio theory of the Gilbert damping in substitutionally disordered ferromagnetic alloys. The theory rests on introduced nonlocal torques which replace traditional local torque operators in the well-known torque-correlation…
We present a general form of the effective spin-chain model for strongly interacting atomic gases with an arbitrary spin in the one-dimensional(1D) traps. In particular, for high-spin systems the atoms can collide in multiple scattering…