The generalized plane piezoelectric problem: Theoretical formulation and application to heterostructure nanowires

TL;DR

This paper introduces a systematic method to simplify 3D piezoelectric problems into 2D forms for elongated systems, enabling efficient and accurate analysis of nanowires with complex geometries and boundary conditions.

Contribution

The authors develop a generalized plane piezoelectric (GPP) formulation that handles diverse geometries, symmetries, and boundary conditions, validated through nanowire simulations.

Findings

GPP approach accurately predicts strain and electric fields.

Significant computational efficiency over full 3D models.

Excellent agreement with exact 3D simulations.

Abstract

We present a systematic methodology for the reformulation of a broad class of three-dimensional (3D) piezoelectric problems into a two-dimensional (2D) mathematical form. The sole underlying hypothesis is that the system geometry and material properties as well as the applied loads (forces and charges) and boundary conditions are translationally invariant along some direction. This class of problems is commonly denoted here as the generalized plane piezoelectric (GPP) problem. The first advantage of the generalized plane problems is that they are more manageable from both analytical and computational points of view. Moreover, they are flexible enough to accommodate any geometric cross section, crystal class symmetry, axis orientation and a wide range of boundary conditions. As an illustration we present numerical simulation of indefinite lattice-mismatched core-shell nanowires made of diamond Ge/Si and zincblende piezoelectric InN/GaN materials. The remarkable agreement with exact 3D simulations of finite versions of those systems reveal the GPP approach as a reliable procedure to study accurately and with moderate computing resources the strain and electric field distribution in elongated piezoelectric systems.