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A GaN/HfZrCO <sub>2</sub> heterojunction with excellent photoresponse and superior hydrogen evolution reaction performance

Zhuo Diao, Zhen Cui, Shuang Zhang

2026Physical Chemistry Chemical Physics9 citationsDOI

Abstract

In this work, first-principles calculations are employed to investigate GaN/HfZrCO 2 heterostructures in terms of structural stability, electronic properties, optoelectronic behavior, and mechanical characteristics.

Topics & Concepts

HeterojunctionMonolayerMaterials scienceOptoelectronicsWork (physics)HydrogenElectronic structureNanotechnologyWide-bandgap semiconductorPhotovoltaic systemGaN-based semiconductor devices and materialsGa2O3 and related materialsZnO doping and properties
A GaN/HfZrCO <sub>2</sub> heterojunction with excellent photoresponse and superior hydrogen evolution reaction performance | Litcius