Matching boundary conditions for lattice dynamics

DOI10.1002/NME.4426zbMath1352.74015OpenAlexW1582512607MaRDI QIDQ2952217

Shao-Qiang Tang, Xianming Wang

Publication date: 30 December 2016

Published in: International Journal for Numerical Methods in Engineering (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1002/nme.4426

zbMATH Keywords

dispersion relationreflection coefficientmolecular dynamicsartificial boundary conditionmultiscale computation

Mathematics Subject Classification ID

Molecular, statistical, and kinetic theories in solid mechanics (74A25)

Related Items (19)

Artificial boundary conditions for the semi-discretized one-dimensional nonlocal Schrödinger equation ⋮ Artificial boundary conditions for out-of-plane motion in penta-graphene ⋮ Artificial boundary conditions for Euler-Bernoulli beam equation ⋮ Stability and Error Analysis for a Second-Order Fast Approximation of the One-dimensional Schrödinger Equation Under Absorbing Boundary Conditions ⋮ Finite difference approach for multiscale computations of atomic chain at finite temperature ⋮ Bridging scale simulation of lattice fracture using enriched space-time Finite Element Method ⋮ Numerical solutions for nonlocal wave equations by perfectly matched layers. II: The two-dimensional case ⋮ Semi-analytical solution for the generalized absorbing boundary condition in molecular dynamics simulations ⋮ Accurate boundary treatment for Riesz space fractional diffusion equations ⋮ Nonlocal matching boundary conditions for non-ordinary peridynamics with correspondence material model ⋮ Eliminating corner effects in square lattice simulation ⋮ Nonlocal Wave Propagation in Unbounded Multi-Scale Media ⋮ A Dynamical Concurrent Multiscale Method Employing a Transmitting Boundary to Minimize Wave Reflections at the Domain Interface ⋮ Accurate Boundary Conditions for Twin Boundary ⋮ Numerical Solution of a Two-Dimensional Nonlocal Wave Equation on Unbounded Domains ⋮ Seamless coupling of molecular dynamics and material point method via smoothed molecular dynamics ⋮ Perfectly matched layers for peridynamic scalar waves and the numerical discretization on real coordinate space ⋮ Numerical computations of nonlocal Schrödinger equations on the real line ⋮ Numerical boundary treatment for shock propagation in the fractional KdV-Burgers equation

Cites Work

• Unnamed Item
• Unnamed Item
• Time history kernel functions for square lattice
• An introduction to computational nanomechanics and materials
• Matching boundary conditions for diatomic chains
• Phonon absorbing boundary conditions for molecular dynamics
• Nonreflecting boundary conditions for discrete waves
• Exact non-reflecting boundary conditions
• A perfectly matched layer for the absorption of electromagnetic waves
• Coupling of atomistic and continuum simulations using a bridging scale decomposition.
• Three-dimensional bridging scale analysis of dynamic fracture
• On the stability of boundary conditions for molecular dynamics
• A finite difference approach with velocity interfacial conditions for multiscale computations of crystalline solids
• A pseudo-spectral multiscale method: interfacial conditions and coarse grid equations
• Multiscale methods for mechanical science of complex materials: Bridging from quantum to stochastic multiresolution continuum
• A mathematical framework of the bridging scale method
• Numerical Absorbing Boundary Conditions for the Wave Equation
• Radiation boundary conditions for acoustic and elastic wave calculations
• A Green's function approach to deriving non‐reflecting boundary conditions in molecular dynamics simulations

This page was built for publication: Matching boundary conditions for lattice dynamics