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Perturbation theory for the formation energy of solitons and polarons in mixed-valence linear chain complex
http://hdl.handle.net/2298/9614
http://hdl.handle.net/2298/9614ffc878b2-da44-4837-9745-2cc64a9b5345
名前 / ファイル | ライセンス | アクション |
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Erratum (25.4 kB)
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PRB_044_13260.pdf (854.0 kB)
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Item type | 学術雑誌論文 / Journal Article(1) | |||||
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公開日 | 2008-10-23 | |||||
タイトル | ||||||
タイトル | Perturbation theory for the formation energy of solitons and polarons in mixed-valence linear chain complex | |||||
言語 | ||||||
言語 | eng | |||||
キーワード | ||||||
主題 | mixed-valence linear chain complex, 混合原子価鎖状錯体, soliton, ソリトン, polaron, ポーラロン, formation energy, 形成エネルギー, perturbation theory, 摂動理論 | |||||
資源タイプ | ||||||
資源タイプ | journal article | |||||
著者 |
Kuroda, Noritaka
× Kuroda, Noritaka× 片岡, 光生× 仁科, 雄一郎 |
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別言語の著者 |
黒田, 規敬
× 黒田, 規敬× 片岡, 光生× 仁科, 雄一郎 |
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内容記述 | ||||||
内容記述 | A perturbation calculation shows that the relative formation energies of solitons and polarons in halogen-bridged linear-chain complexes depend strongly on the transfer term and Coulomb interactions even if the electron-lattice coupling is dominant. As the values of the transfer term and Coulomb interactions increase, various soliton states tend to have energies close to one another. It is suggested that the neutral soliton of two-site type is the lowest-energy defect state in a certain range of the strengths of those perturbations. This situation is consistent with the results of the ultraviolet-induced EPR experiment in [Pt(en)2][Pt(en)2Cl2](ClO4)4 (with en=ethylenediamine). The present theory provides an explanation for a highly mobile character of the neutral soliton observed in this material. | |||||
内容記述 | ||||||
内容記述 | ハロゲン架橋擬一次元錯体のソリトンとポーラロンの安定性を初めて摂動理論で考察した。これにより、ソリトンとポーラロンの形成エネルギーが強い電子・格子結合で支配されるが、移動積分とクーロン相互作用にも敏感に依存することが明らかになった。特にクーロン相互作用によって2サイト型の中性ソリトンが安定に生成されうることがこの理論計算で示され、最近のEPR実験と合致する。また、移動積分の値が増せばソリトンの可動性が顕著に高まることも明らかとなり実験事実をよく説明する。 | |||||
書誌情報 |
Physical Review B 巻 44, 号 24, p. 13260-13269, 発行年 1991-12-15 |
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ISSN | ||||||
収録物識別子 | 01631829 | |||||
書誌レコードID | ||||||
収録物識別子 | AA00362255 | |||||
DOI | ||||||
関連タイプ | isIdenticalTo | |||||
関連識別子 | 10.1103/PhysRevB.44.13260 | |||||
権利 | ||||||
権利情報 | ©1991 The American Physical Society | |||||
フォーマット | ||||||
内容記述 | application/pdf | |||||
フォーマット | ||||||
内容記述 | application/pdf | |||||
形態 | ||||||
854009 bytes | ||||||
形態 | ||||||
25405 bytes | ||||||
著者版フラグ | ||||||
出版タイプ | VoR | |||||
日本十進分類法 | ||||||
主題 | 428.4 | |||||
その他の言語のタイトル | ||||||
その他のタイトル | 混合原子価鎖状錯体におけるソリトンとポーラロンの形成エネルギーのための摂動論 | |||||
タイトル(ヨミ) | ||||||
その他のタイトル | コンゴウ ゲンシカ サジョウ サクタイ ニ オケル ソリトン ト ポーラロン ノ ケイセイ エネルギー ノ タメ ノ セツドウロン | |||||
出版者 | ||||||
出版者 | The American Physical Society | |||||
資源タイプ | ||||||
内容記述 | 論文(Article) | |||||
資源タイプ・ローカル | ||||||
雑誌掲載論文 | ||||||
資源タイプ・NII | ||||||
Journal Article | ||||||
資源タイプ・DCMI | ||||||
text | ||||||
資源タイプ・ローカル表示コード | ||||||
01 | ||||||
URL | ||||||
内容記述 | http://link.aps.org/abstract/PRB/v44/p13260 | |||||
コメント | ||||||
黒田規敬: 熊本大学大学院自然科学研究科マテリアル工学講座・工学部マテリアル工学科 |