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Oxygen at High Pressures : Theoretical Approach to Monoatomic Phases

フォーマット:
論文
責任表示:
Oda, Tatsuki ; Sugimori, K. ; Nagao, Hidemi ; Hamada, I. ; Kagayama, S. ; Geshi, M. ; Nagara, H. ; Kusakabe, K. ; Suzuki, N.
言語:
英語
出版情報:
Institute of Physics, 2007-09-12
著者名:
Oda, Tatsuki
Sugimori, K.
Nagao, Hidemi
Hamada, I.
Kagayama, S.
Geshi, M.
Nagara, H.
Kusakabe, K.
Suzuki, N.
続きを見る
掲載情報:
Journal of Physics Condensed Matter
ISSN:
0953-8984  CiNii Research  Webcat Plus  JAIRO
巻:
19
通号:
36
開始ページ:
365211
バージョン:
author
概要:
金沢大学理工研究域 数物科学系<br />We have studied the ζ-phase of solid oxygen using the generalized gradient approximation in the density functional approach. Calculations of total energies and pressures have been carried out for the prototyp e of diatomic ζ-phase and other hypothetical monoatomic crystal structures. The diatomic phase was found to be stable over a wide range of pressure (100-2000GPa). The stacking of molecular layers is discussed in comparison with the available experimental data. © IOP Publishing Ltd. 続きを見る
URL:
http://hdl.handle.net/2297/11763
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