相关论文: Modelling Arbitrary Complex Dielectric Properties …
Saddle point search schemes are widely used to identify the transition state of different processes, like chemical reactions, surface and bulk diffusion, surface adsorption, and many more. In solid-state materials with relatively large…
Ground-penetrating radar (GPR) is a mature geophysical method that has gained increasing popularity in planetary science over the past decade. GPR has been utilised both for Lunar and Martian missions providing pivotal information regarding…
The spatial sensor characteristics of a 6cm TDR flat band cable sensor section was simulated with finite element modelling (High Frequency Structure Simulator-HFSS) under certain conditions: (i) in direct contact to the surrounding material…
Ground Penetrating Radar (GPR) is one of the most important non-destructive evaluation (NDE) devices to detect the subsurface objects (i.e. rebars, utility pipes) and reveal the underground scene. One of the biggest challenges in GPR based…
We propose an explicit iterative leap-frog discontinuous Galerkin method for time-domain Maxwell's equations in anisotropic materials and derive its convergence properties. The a priori error estimates are illustrated by numerical means in…
A semi-implicit finite difference time domain (FDTD) numerical Maxwell solver is developed for full electromagnetic Particle-in-Cell (PIC) codes for the simulations of plasma-based acceleration. The solver projects the volumetric Yee…
Density-functional perturbation theory (DFPT) is nowadays the method of choice for the accurate computation of linear and non-linear response properties of materials from first principles. A notable advantage of DFPT over alternative…
This technical note describes the physical model, numerical implementation, and validation of multilevel atomic media for lasers and saturable absorbers in Meep: a free/open-source finite-difference time-domain (FDTD) software package for…
The diffusion/relaxation behavior of polarized spins of pore filling fluid, as often probed by NMR relaxometry, is widely used to extract information on the pore-geometry. Such information is further interpreted as an indicator of the key…
By including a fraction of exact exchange (EXX), hybrid functionals reduce the self-interaction error in semi-local density functional theory (DFT), and thereby furnish a more accurate and reliable description of the electronic structure in…
The finite-difference time-domain (FDTD) method is a flexible and powerful technique for rigorously solving Maxwell's equations. However, three-dimensional optical nonlinearity in current commercial and research FDTD softwares requires…
The modeling and simulation of electromagnetic wave propagation is often accompanied by a restriction to bounded domains which requires the introduction of artificial boundaries. The corresponding boundary conditions should be chosen in…
Accurately estimating friction coefficients between arbitrary material pairs is critical for robotics, digital fabrication, and physics-based simulation, but exhaustive pairwise testing scales quadratically with the number of materials. We…
We present an efficient separation of variables algorithm for the evaluation of imaginary time Feynman diagrams appearing in the bold pseudo-particle strong coupling expansion of the Anderson impurity model. The algorithm uses a fitting…
The most popular methods for self-consistent simulation of fields interacting with charged species is using finite difference time domain (FDTD) methods together with Newton's laws of motion to evolve locations and velocities of particles.…
This paper presents a new code for performing multidimensional radiation hydrodynamic (RHD) simulations on parallel computers involving anisotropic radiation fields and nonequilibrium effects. The radiation evolution modules described here…
In this paper, the Combined Finite-Discrete Element Method (FDEM) has been applied to analyze the deformation of anisotropic geomaterials. In the most general case geomaterials are both non-homogeneous and non-isotropic. With the aim of…
We propose a novel finite-difference time-domain (FDTD) scheme for the solution of the Maxwell's equations in which linear dispersive effects are present. The method uses high-order accurate approximations in space and time for the…
Electromagnetic scattering and absorption by material particles is a fundamental physical problem with a broad range of applications, going from laboratory experiments, biology and material sciences, all the way up to environmental studies…
We consider a boundary problem for 1D electrodynamics modeling of a pulse propagation in a metamaterial medium. We build and apply projecting operators to a Maxwell system in time domain that allows to split the linear propagation problem…