Výsledky vyhledávání

A density functional study of small sized silver-doped silicon clusters: Ag2Sin (n = 1–13)

Autor: Gen Quan Li, Cai Yang, Shuai Zhang, Mao Fen Ma, Song Hao Jia, Cheng Lu

Publikováno v: The European Physical Journal D. 69

The structures and electronic properties for global minimum geometric structures of small-sized neutral Ag2Si n (n = 1–13) clusters have been investigated using the CALYPSO structure searching method coupled with density functional theory calculati

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::865df10661bcbad59285adb9accc1e55
https://doi.org/10.1140/epjd/e2015-60404-1

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Structure, stability and electronic properties of SrSi n ( n = 1–12) clusters: Density-functional theory investigation

Autor: Gen-Quan Li, Shuai Zhang, Yi Qin, Mao-Fen Ma, Cheng Lu

Publikováno v: Chinese Physics B. 23:013601

The geometries, stabilities, and electronic properties of FSin (n = 1 ~ 12) clusters are systematically investigated by using first-principles calculations based on the hybrid density-functional theory at the B3LYP/6-311G level. The geometries are fo

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::d960c84cfe0abd6b7c5d5c380dd4898a
https://doi.org/10.1088/1674-1056/23/1/013601

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Akademický článek

Structure, stability and electronic properties of SrSin (n = 1–12) clusters: Density-functional theory investigation.

Autor: Shuai, Zhang, Yi, Qin, Mao-Fen, Ma, Cheng, Lu, Gen-Quan, Li

Publikováno v: Chinese Physics B; Jan2014, Vol. 23 Issue 1, p013601-013608, 8p

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