相关论文: General method for obtaining the energy minimum of…

We consider the mapping of tight-binding electronic structure theory to a local spin Hamiltonian, based on the adiabatic approximation for spin degrees of freedom in itinerant-electron systems. Local spin Hamiltonians are introduced in…

Energy versus magnetic-field diagram of the spin-$1$ Haldane system with an impurity bond is studied in terms of spin-1/2 degree of freedom at the sites neighboring the impurity bond by means of analytical method. We examine the equivalence…

Recently, spatial photonic Ising machines (SPIM) have been demonstrated to compute the minima of Hamiltonians for large-scale spin systems. Here we propose to implement an antiferromagnetic model through optoelectronic correlation computing…

Quantum-chemical calculations aimed at deriving magnetic coupling constants in exchange-coupled spin clusters commonly utilize a broken-symmetry (BS) approach. This involves calculating several distinct collinear spin configurations,…

The recent development in the field of 2D magnetic materials urges reliable theoretical methodology for determination of magnetic properties. Among the available methods, ab initio four-state energy mapping based on Density Functional…

Understanding the quantum dynamics of spin defects and their coherence properties requires accurate modeling of spin-spin interaction in solids and molecules, for example by using spin Hamiltonians with parameters obtained from…

We study an antiferromagnetic spin-1/2 model with up to third nearest-neighbor couplings on the Kagome lattice in the easy-axis limit, and show that its low-energy dynamics are governed by a four site XY ring exchange Hamiltonian. Simple…

We prove a result for the spin-$1/2$ quantum Heisenberg ferromagnet on $d$-dimensional boxes $\{1,\dots,L\}^d \subset \mathbb{Z}^d$. For any $n$, if $L$ is large enough, the Hamiltonian satisfies: among all vectors whose total spin is at…

For a wide class of Hamiltonians, a novel method to obtain lower and upper bounds for the lowest energy is presented. Unlike perturbative or variational techniques, this method does not involve the computation of any integral (a…

We study the problem of determining the Hamiltonian of a fully connected Ising Spin Glass of $N$ units from a set of measurements, whose sizes needs to be ${\cal O}(N^2)$ bits. The student-teacher scenario, used to study learning in…

A new variational technique for investigation of the ground state and correlation functions in 1D quantum magnets is proposed. A spin Hamiltonian is reduced to a fermionic representation by the Jordan-Wigner transformation. The ground state…

We study the problem to infer the ground state of a spin-glass Hamiltonian using data from another Hamiltonian with interactions disturbed by noise from the original Hamiltonian, motivated by the ground-state inference in quantum annealing…

Starting from a modified version of the the S=1/2 Kagome antiferromagnet to emphasize the role of elementary triangles, an effective Hamiltonian involving spin and chirality variables is derived. A mean-field decoupling that retains the…

A central challenge in quantum simulation is to prepare low-energy states of strongly interacting many-body systems. In this work, we study the problem of preparing a quantum state that optimizes a random all-to-all, sparse or dense, spin…

Spin models like the Heisenberg Hamiltonian effectively describe the interactions of open-shell transition-metal ions on a lattice and can account for various properties of magnetic solids and molecules. Numerical methods are usually…

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…

We develop a simple and unbiased numerical method to obtain the uniform susceptibility of quantum many body systems. When a Hamiltonian is spatially deformed by multiplying it with a sine square function that smoothly decreases from the…

Implicit in the study of magnetic materials is the concept of spin Hamiltonians, which emerge as the low-energy theories of correlation-driven insulators. In order to predict and establish such Hamiltonians for real materials, a variety of…

The spin-1/2 Heisenberg model is formulated in terms of a mean-field approximation (MFA) by using the matrix forms of spin operators $\hat{S}_x,\hat{S}_y$ and $\hat{S}_z$ in three-dimensions. The considered Hamiltonian consists of bilinear…

A fermion ground state energy functional is set up in terms of particle density, relative pair density, and kinetic energy tensor density. It satisfies a minimum principle if constrained by a complete set of compatibility conditions. A…