Calculation of the Electronic Structure of Positive Muon and Boron at the Tetrahedral Interstitial Site in Silicon
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概要
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The spin-polarized calculation of the electronic structure around a positivemuon and boron at the tetrahedral interstitial site in silicon is carried out byuse of the local spin-density functional formalism and the linear combination ofatomic orbitals-Green's function method. A paramagnetic solution is obtained.Bonding hyper-deep impurity states below the valence band and antibondingdeep ones in the gap caused by the strong .s'p-hybridization between the impurityorbitals and the tails of the surrounding host orbitals appear. The calculatedvalue of the reduction of hyperfine coupling constant, A, experienced by positivemuon at absolute zero temperature is in good agreement with the experimentalone. The hyperfine field of boron is predicted to be -F-29.72kG. The l.s' core-polarization makes large negative contribution to the hyperfine field in the caseof boron.
- 社団法人日本物理学会の論文
- 1984-03-15
著者
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YOSHIDA Hiroshi
Department of Clinical Laboratory Medicine, Fukushima Medical College
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SHINDO Koichi
College of Humanities and Social Science, Iwate University
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Yoshida Hiroshi
Department Of Biophysics Graduate School Of Science Kyoto University
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Shindo Koichi
College Of Humanities And Social Science
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Yoshida Hiroshi
Department Of Physics Tohoku University:solar Energy Research Institute
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Yoshida Hiroshi
Departmen Of Radiology School Of Medicine Asahikawa Medical University
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Katayama-Yoshida Hiroshi
Department of Computational Nanomaterials Design, Nanoscience and Nanotechnology Center, The Institute of Scientific and Industrial Research (ISIR), Osaka University, 8-1 Mihogaoka, Ibaraki, Osaka 567-0047, Japan
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