相关论文: DFT2kp: effective kp models from ab-initio data

An ultracold gas of heteronuclear alkali dimer molecules with hyperfine structure loaded into a one-dimensional optical lattice is investigated. The \emph{Hyperfine Molecular Hubbard Hamiltonian} (HMHH), an effective low-energy lattice…

This paper derives master equations for an atomic two-level system for a large set of unitarily equivalent Hamiltonians without employing the rotating wave and certain Markovian approximations. Each Hamiltonian refers to physically…

Aiming at relativistic description of gluons in hadrons, the renormalization group procedure for effective particles (RGPEP) is applied to baryons in QCD of heavy quarks. The baryon eigenvalue problem is posed using the Fock-space…

We construct an effective Hamiltonian via Monte Carlo from a given action. This Hamiltonian describes physics in the low energy regime. We test it by computing spectrum, wave functions and thermodynamical observables (average energy and…

We investigate the gravitational form factors of charmonium. Our method is based on a Hamiltonian formalism on the light front known as basis light-front quantization. The charmonium mass spectrum and light-front wave functions were…

The standard formulation of parton physics involves light-cone correlations of quark and gluon fields in a hadron, which leads to a widespread impression that it can only be studied through real-time Hamiltonian dynamics or light-front…

While density functional theory (DFT) serves as a prevalent computational approach in electronic structure calculations, its computational demands and scalability limitations persist. Recently, leveraging neural networks to parameterize the…

Large scale Density Functional Theory (DFT) based electronic structure calculations are highly time consuming and scale poorly with system size. While semi-empirical approximations to DFT result in a reduction in computational time versus…

This work proposes a new efficient approach for calculating the bending stiffness of two-dimensional materials using simple atomistic tests on small periodic unit cells. The tests are designed such that bending deformations are dominating…

Hamiltonian truncation is a non-perturbative numerical method for calculating observables of a quantum field theory. The starting point for this method is to truncate the interacting Hamiltonian to a finite-dimensional space of states…

We consider zero temperature behavior of dynamic response functions of 1D systems near edges of support in momentum-energy plane $(k, \omega).$ The description of the singularities of dynamic response functions near an edge $\epsilon(k)$ is…

Starting from the Fock space representation of hadron bound states in a quark model, a change of representation is implemented by a unitary transformation such that the composite hadrons are redescribed by elementary-particle field…

We present a non-perturbative framework for deriving effective Hamiltonians that describe low-energy excitations in quantum many-body systems. The method combines block diagonalization based on the Cederbaum--Schirmer--Meyer transformation…

In the large-momentum effective field theory approach to parton physics, the matrix elements of non-local operators of quark and gluon fields, linked by straight Wilson lines in a spatial direction, are calculated in lattice quantum…

We compute the effective hamiltonian for non-leptonic |Delta F| = 1 decays in the standard model including next-to-next-to-leading order QCD corrections. In particular, we present the complete three-loop anomalous dimension matrix…

We consider a single particle tunnelling in a tight-binding model with nearest-neighbour couplings, in the presence of a periodic high-frequency force. An effective Hamiltonian for the particle is derived using an averaging method…

A formulation of quantum mechanics is introduced based on a $2D$-dimensional phase-space wave function $\text{\reflectbox{\text{p}}}\mkern-3mu\text{p}\left(q,p\right)$ which might be computed from the position-space wave function…

We build and probe a $\mathbb{Z}_2$ spin liquid in a programmable quantum device, the D-Wave DW-2000Q. Specifically, we observe the classical 8-vertex and 6-vertex (spin ice) states and transitions between them. To realize this state of…

The purpose of this experiment was to use the known analytical techniques to study the creation, simulation, and measurements of molecular Hamiltonians. The techniques used consisted of the Linear Combination of Atomic Orbitals (LCAO), the…

For a prototype quadratic Hamiltonian describing a driven, dissipative system, exact matrix elements of the reduced density matrix are obtained from a generating function in terms of the normal characteristic functions. The approach is…