First-principles calculations on the interfacial, electronic and photocatalytic properties of the Ta<sub>3</sub>N<sub>5</sub>/SrTaO<sub>2</sub>N heterostructure
The type-II band alignment of Ta 3 N 5 (110)/SrTaO 2 N(001) is favorable to the separation of photoinduced carriers.
Authors
- Xin Zhou (ORCID: https://orcid.org/0000-0002-4385-8379)
- Huan Zhang (ORCID: https://orcid.org/0000-0003-2284-4274)
- He Qu (ORCID: https://orcid.org/0000-0002-3826-7101)
Institutions
- Liaoning Normal University (CN)
- Dalian University (CN)
Publication Details
- Journal
- New Journal of Chemistry
- Published
- 2025-01-01
- DOI
- https://doi.org/10.1039/d5nj00468c
- Primary Topic
- Electronic and Structural Properties of Oxides
- Type
- article
- Field-Weighted Citation Impact
- 0.00
Funders
- National Natural Science Foundation of China
- Dalian Institute of Chemical Physics