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Theoretical studies on the BN substituted fullerenes C70−2x(BN)x (x=1–3)—isoelectronic equivalents of C70

✍ Scribed by Z Chen; K Ma; Y Pan; X Zhao; A Tang

Book ID
114143643
Publisher
Elsevier Science
Year
1999
Tongue
English
Weight
178 KB
Volume
490
Category
Article
ISSN
0166-1280

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✍ Efthimios Kaxiras; Koblar Jackson; Mark R. Pederson 📂 Article 📅 1994 🏛 Elsevier Science 🌐 English ⚖ 625 KB

We present a first-principles theoretical study of complexes formed by combination of C rings and group-v atoms, which are the passivated analogs of the Crs fullerene. We study structural and electronic properties of &X4 clusters, with X=N, P, As, in comparison to Css and C2sH4. All clusters with gr