Publication Date

1-1-2024

Document Type

Conference Proceeding

Publication Title

Journal of Physics: Conference Series

Volume

2751

Issue

1

DOI

10.1088/1742-6596/2751/1/012013

Abstract

In recent years, two-dimensional (2D) pentagonal ternary monolayers have attracted much attention and emerged as a new class of materials because of their new feature and extensive applicability. Using first-principles density functional theory (DFT) calculations, we predict a new 2D pentagonal-SiPN or p-SiPN monolayer material. The new monolayer has shown to be structurally, thermodynamically, and dynamically stable. Our findings imply that p-SiPN is a wide and indirect bandgap semiconductor, with a highly tunable bandgap with applied equ-biaxial strain. This makes p-SiPN a promising candidate for futuristic optoelectronics and nanomechanics device applications.

Creative Commons License

Creative Commons License
This work is licensed under a Creative Commons Attribution 4.0 License.

Department

Chemical and Materials Engineering

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