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Indirect-To-Direct Band Gap Transition of One-Dimensional V(2)Se(9): Theoretical Study with Dispersion Energy Correction

[Image: see text] Recently, we synthesized a one-dimensional (1D) structure of V(2)Se(9). The 1D V(2)Se(9) resembles another 1D material, Nb(2)Se(9), which is expected to have a direct band gap. To determine the potential applications of this material, we calculated the band structures of 1D and bul...

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Detalles Bibliográficos
Autores principales: Lee, Weon-Gyu, Chae, Sudong, Chung, You Kyoung, Yoon, Won-Sub, Choi, Jae-Young, Huh, Joonsuk
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2019
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6844153/
https://www.ncbi.nlm.nih.gov/pubmed/31720541
http://dx.doi.org/10.1021/acsomega.9b02655