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First-principles study on stability and photoelectron spectroscopy of GanAs2(n=1–9) clusters

✍ Scribed by Ma, Deming; Qiao, Hongbo; Shi, Wei; Li, Enling; Ma, Youheng; Wang, Wei


Book ID
122835025
Publisher
Elsevier Science
Year
2014
Tongue
English
Weight
940 KB
Volume
118
Category
Article
ISSN
1386-1425

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First-principles study on stability and
✍ Xiao-Jun Ren; Bao-Xing Li 📂 Article 📅 2010 🏛 Elsevier Science 🌐 English ⚖ 422 KB

We have investigated the structures, stabilities and magnetism of zinc-doped Al n (n =1-9) clusters in detail by using first-principles density functional theory. Our calculated results indicate that the ground state structures of the mixed Al n Zn (n = 1-9) clusters doped with one zinc atom can be