Related papers: A Computational Phase Function Method for $\alpha-…
The single-particle Green's function (GF) of mesoscopic structures plays a central role in mesoscopic quantum transport. The recursive GF technique is a standard tool to compute this quantity numerically, but it lacks physical transparency…
In this paper, we propose a new nonuniform mesh method to simulate acoustic scattering problems in two dimensional periodic structures with non-periodic incident fields numerically. As existing methods are difficult to extend to higher…
New method for ab initio calculations of the properties of large size system based on phase-amplitude functional is presented. It is shown that Schrodinger equation for many electrons complex system including large size molecules, or…
We report a new resummation procedure for the partial wave series (PWS) representation of the scattering amplitude, when a basis set of Legendre polynomials is used for the expansion. The effect of the resummation is to remove from the PWS…
We propose an alternative approach to L\"uscher's formula for extracting two-body scattering phase shifts from finite volume spectra with no reliance on the partial wave expansion. We use an effective-field-theory-based Hamiltonian method…
The phase field crystal (PFC) method has emerged as a promising technique for modeling materials with atomistic resolution on mesoscopic time scales. The approach is numerically much more efficient than classical density functional theory…
This paper presents a novel approach for computing substructure characteristic modes. This method leverages electromagnetic scattering matrices and spherical wave expansion to directly decompose electromagnetic fields. Unlike conventional…
A compressive sensing (CS) reconstruction method for polynomial phase signals is proposed in this paper. It relies on the Polynomial Fourier transform, which is used to establish a relationship between the observation and sparsity domain.…
We consider symmetry-projected Hartree--Fock trial wave functions in constrained-path Monte Carlo (CPMC) calculations. Previous CPMC calculations have mostly employed Hartree--Fock (HF) trial wave functions, restricted or unrestricted. The…
Extensions of the split-step Fourier method (SSFM) for Schr\"odinger-type pulse propagation equations for simulating femto-second pulses in single- and two-mode optical communication fibers are developed and tested for Gaussian pulses. The…
We present simulation results for a model polymer melt, consisting of short, nonentangled chains, in the supercooled state. The analysis focuses on the monomer dynamics, which is monitored by the incoherent intermediate scattering function.…
Recent theoretical and experimental advances have shed light on the existence of so-called `perfectly transmitting' wavefronts with transmission coefficients close to 1 in strongly backscattering random media. These perfectly transmitting…
We propose a method for analyzing two-dimensional symmetry protected topological (SPT) wavefunctions using a correspondence with conformal field theories (CFTs) and integrable lattice models. This method generalizes the CFT approach for the…
In this paper a sublinear time algorithm is presented for the reconstruction of functions that can be represented by just few out of a potentially large candidate set of Fourier basis functions in high spatial dimensions, a so-called…
We present a numerical approach to the solution of elastic phonon scattering problems based on a frequency domain decomposition of the atomistic equations of motion and the use of perfectly matched layer or PML boundaries. Unlike MD…
The embedding method for the calculation of the conductance through interacting systems connected to single channel leads is generalized to obtain the full complex transmission amplitude that completely characterizes the effective…
This work presents the Griffith-type phase-field formation at large deformation in the framework of adaptive edge-based smoothed finite element method (ES-FEM) for the first time. Therein the phase-field modeling of fractures has attracted…
Traditional multiconfiguration Hartree-Fock (MCHF) and configuration interaction (CI) methods are based on a single orthonormal orbital basis (OB). For atoms with complicated shell structures, a large OB is needed to saturate all the…
This work introduces a novel Fourier phase retrieval model, called polarimetric phase retrieval that enables a systematic use of polarization information in Fourier phase retrieval problems. We provide a complete characterization of…
The spectrum of excited states observed in the finite volume of lattice QCD is governed by the discrete symmetries of the cubic group. This finite group permits the mixing of orbital angular momentum quanta in the finite volume. As…