Deterministic Realization of Complex Local Strain Fields and Bandgap Profiles in Two-Dimensional Materials
Lottie L. Murray, Eric Herrmann, Igor Evangelista, Sai Rahul Sitaram, Ke Ma, Anderson Janotti, Xi Wang, and Matthew F. Doty

TL;DR
This paper presents a deterministic, geometry-based method for controlling local strain and bandgap profiles in 2D materials, validated through experiments and modeling, enabling precise optoelectronic property engineering.
Contribution
The authors introduce a material-agnostic platform using nanostructure geometry to predict and control strain and bandgap distributions in 2D materials with high accuracy.
Findings
Hyperspectral photoluminescence mapping quantifies strain-to-bandgap relations.
A two-component analytical model predicts bandgap shifts with less than 12% error.
The approach is extendable to other 2D materials.
Abstract
Emerging classical and quantum device concepts demand precise spatial control over the optoelectronic properties of two-dimensional (2D) materials, but deterministic engineering via local multiaxial strain distributions remains challenging. Using GaSe, we demonstrate a material-agnostic platform in which nanostructure geometry deterministically prescribes in-plane strain profiles in suspended van der Waals membranes. We first use hyperspectral photoluminescence mapping and experimentally-constrained finite element analysis to quantify the experimental biaxial and uniaxial strain gauge factors that relate strain to the change in bandgap. We next show that a two-component analytical model can predict, with less than 12% error, spatially-resolved bandgap shifts arising from multiaxial strain distributions in complex geometries, including the interactions between adjacent…
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