Electronic and Magnetic Structure of Monolayer MnAs (111): A case study by DFT
- Title
- Electronic and Magnetic Structure of Monolayer MnAs (111): A case study by DFT
- Abstract
- We have calculated the electronic and magnetic properties of the monolayer MnAs (111) using a variety of density functional theory (DFT) approaches including PBE-GGA. By cutting the bulk crystalline MnAs in the NiAs-type phase and (111) direction, the properties of this compound have completely changed, and the half-metallic property changes to metallic, and its magnetic properties are increased. The Mn atom has the most effect in creating a stronger magnetic state in the monolayer MnAs (111). In spin up and down, the most electronic states of the Mn atom belong to the valence and the conduction region respectively. The material response to the incident light in the visible light region, as well as the low energy loss in both directions in this region, promises to use it with the lowest range of energy loss in optical applications.
- Scientific Type
- غير معروف
- Journal volume
- Volume 7, Issue 3
- Collaboration type
- مشترك
- Publish Date
- April 1, 2024
- Participated Universities (Publication)
-
Alnoor University
- Scopus status
- In Scopus
- Scopus index year
- 2 024
- Scopus quarter
- 2
- Scopus citation score
- 3.700000048
- Clarivate status
- Not In Clarivate
- Pub. Med. status
- Not In PubMed
- Author (Publication)
- احمد عبد الستار داؤود سليمان
- Journal (Publication)
-
Chemical Review and Letters
- Publisher (Publication)
- Iranian Chemical Science and Technologies Association
- ISSN
- 2676-7279
- Country (Publication)
-
Iran
- Country type
- عالمية
- College (Publication)
-
College of Health and Medical Technologies
- Departement (Publication)
-
Department of Medical laboratories techniques
- Media
-
Academic paper
Part of Electronic and Magnetic Structure of Monolayer MnAs (111): A case study by DFT