Ab initio molecular dynamics simulation on the formation process of He@C60 synthesized by explosion-Reference-Cited by-同舟云学术

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Ab initio molecular dynamics simulation on the formation process of He@C60 synthesized by explosion

Published:2013-01-08 Issue:4 Volume:19 Page:1705-1710
ISSN:1610-2940
Container-title:Journal of Molecular Modeling
language:en
Short-container-title:J Mol Model

Author:

Li Jian-Ying,Liu Li-Min,Jin Bo,Liang Hua,Yu Hai-Jun,Zhang Hong-Chang,Chu Shi-Jin,Peng Ru-Fang

Publisher

Springer Science and Business Media LLC

Subject

Computational Theory and Mathematics,Inorganic Chemistry,Organic Chemistry,Physical and Theoretical Chemistry,Computer Science Applications,Catalysis

Link

http://link.springer.com/content/pdf/10.1007/s00894-012-1737-0.pdf

Reference39 articles.

1. Ball P (2011) Material witness: caged water. Nat Mater 10:649–649. doi: 10.1038/nmat3107

2. Ju CY, Suter D, Du JF (2007) Two-qubit gates between noninteracting qubits in endohedral-fullerene-based quantum computation. Phys Rev A 75:12318–12322

3. Cimpoesu F, Ito S, Shimotani H, Takagi H, Dragoe N (2011) Vibrational properties of noble gas endohedral fullerenes. Phys Chem Chem Phys 13:9609–9615

4. Saunders M, Jiménez-Vázquez HA, Cross RJ, Mroczkowski S, Freedberg DI, Anet FAL (1994) Probing the interior of fullerenes by 3He NMR spectroscopy of endohedral 3He@C60 and 3He@C70. Nature 367:256–258

5. Buhl M, Patchkovskii S, Thiel W (1997) Interaction energies and NMR chemical shifts of noble gases in C60. Chem Phys Lett 275:14–18

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