DFT study of the structural, electronic, and optical properties of bulk, monolayer, and bilayer Sn-monochalcogenides

Tin monochalcogenides (SnSe, SnS), with advantages of earth abundance, environmental friendly, chemical stability, and less toxicity can be used in Li-ion batteries, piezoelectric, optoelectronics, sensors, and thermoelectric. Here, we used the ultra-soft pseudo-potential technique depending on dens...

Täydet tiedot

Bibliografiset tiedot

Päätekijät:	Attia Batool, Youqi Zhu, Xilan Ma, Muhammad Imran Saleem, Chuanbao Cao
Aineistotyyppi:	Artigo
Kieli:	Inglês
Julkaistu:	Elsevier 2022-10-01
Sarja:	Applied Surface Science Advances
Aiheet:	DFT Calculation CASTEP Monochalcogenides Electronic Optical Properties
Linkit:	http://www.sciencedirect.com/science/article/pii/S2666523922000654
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