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Updated: May 23, 2025

Probe Type II Band Alignment in One-Dimensional Van Der Waals Heterostructures Using First-Principles Calculations
Published on: October 12, 2019
Bias dependent band alignment in Ga2O3 ferroelectric interface by operando HAXPES
Anthony Boucly1,2, Tyson C Back3, Thaddeus J Asel3
1SPEC, CEA, CNRS, , Université Paris-Saclay, CEA Saclay, Gif-sur-Yvette, 91191, France. anthony.boucly@sorbonne-universite.fr.
This study investigates Hafnium Zirconium Oxide (HZO) on Gallium Oxide interfaces. Charge trapping prevents ferroelectric polarization, leading to bias-induced band skewing in the band alignment.
Area of Science:
- Materials Science
- Semiconductor Physics
- Nanotechnology
Background:
- Gallium oxide (Ga2O3) is a wide band gap semiconductor with potential for power electronics.
- Germanium (Ge) is explored as an n-type dopant for Ga2O3 due to its shallow donor level and favorable growth.
- Hafnium Zirconium Oxide (HZO) is a ferroelectric material with potential applications in memory and logic devices.
Purpose of the Study:
- To investigate the band alignment at the interface of HfZrO4 (HZO) and Ge-doped Ga2O3.
- To understand the impact of Ge doping on Ga2O3 properties for HZO integration.
- To explore the feasibility of utilizing ferroelectric polarization in HZO for device applications.
Main Methods:
- Hard X-ray Photoelectron Spectroscopy (HAXPES) with in situ bias application to measure band alignment.
- High-Resolution Transmission Electron Microscopy (HRTEM) for structural characterization.
- Electrical characterization to assess charge injection and trapping.
Main Results:
- Structural analysis confirmed the polar orthorhombic phase of HZO.
- Electrical characterization revealed charge injection and trapping at the HZO/Ga2O3 interface.
- These interfacial issues prevent the stabilization of ferroelectric polarization in HZO.
- The band alignment is dominated by bias-induced band skewing due to a leaky HZO layer.
Conclusions:
- The integration of HZO with Ge-doped Ga2O3 faces challenges due to interfacial charge effects.
- Ferroelectric polarization in HZO is not stabilized under these conditions.
- The band alignment is significantly influenced by applied bias, leading to band skewing.
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