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Electron-pair radii and relative sizes of atoms
http://hdl.handle.net/10258/853
http://hdl.handle.net/10258/85353955112-41bf-44bb-9cac-05a12b84d482
名前 / ファイル | ライセンス | アクション |
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186_JCP112_2000_6966.pdf (747.8 kB)
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Item type | 学術雑誌論文 / Journal Article.(1) | |||||
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公開日 | 2012-03-14 | |||||
タイトル | ||||||
言語 | en | |||||
タイトル | Electron-pair radii and relative sizes of atoms | |||||
言語 | ||||||
言語 | eng | |||||
キーワード | ||||||
言語 | en | |||||
主題Scheme | Other | |||||
主題 | atomic structure | |||||
キーワード | ||||||
言語 | en | |||||
主題Scheme | Other | |||||
主題 | probability | |||||
キーワード | ||||||
言語 | en | |||||
主題Scheme | Other | |||||
主題 | electron pairs | |||||
資源タイプ | ||||||
資源タイプ識別子 | http://purl.org/coar/resource_type/c_6501 | |||||
資源タイプ | journal article | |||||
アクセス権 | ||||||
アクセス権 | open access | |||||
アクセス権URI | http://purl.org/coar/access_right/c_abf2 | |||||
著者 |
古賀, 俊勝
× 古賀, 俊勝 |
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抄録 | ||||||
内容記述タイプ | Abstract | |||||
内容記述 | The electron-pair intracule (relative motion) h(u) and extracule (center-of-mass motion) d(R) densities represent probability densities for the interelectronic distance and the center-of-mass radius of any pairs of electrons, respectively. For 102 atoms from He (atomic number Z = 2) to Lr (Z = 103), we report that electron-pair radii R_2i and R_2e, defined by h(R_2i) = c_2i and d(R_2e) = c_2e, have good linear correlations with the relative sizes R_1 of atoms introduced based on the single-electron density ρ(r) such that ρ(R_1) = c_1, where c_1, c_2i, and c_2e are constants common to the 102 atoms. It is also shown that an interesting relation R_2e ≅ R_2i/2 holds, if c_2e is set equal to 8_c2i. | |||||
言語 | en | |||||
書誌情報 |
en : The journal of chemical physics 巻 112, 号 16, p. 6966-6970, 発行日 2000-04-22 |
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出版者 | ||||||
言語 | en | |||||
出版者 | American Institute of Physics | |||||
出版者版へのリンク | ||||||
10.1063/1.481294 | ||||||
https://doi.org/10.1063/1.481294 | ||||||
DOI | ||||||
関連タイプ | isIdenticalTo | |||||
識別子タイプ | DOI | |||||
関連識別子 | 10.1063/1.481294 | |||||
論文ID(NAID) | ||||||
関連タイプ | isIdenticalTo | |||||
識別子タイプ | NAID | |||||
関連識別子 | 120003895607 | |||||
日本十進分類法 | ||||||
主題Scheme | NDC | |||||
主題 | 431.19 | |||||
ISSN | ||||||
収録物識別子タイプ | PISSN | |||||
収録物識別子 | 00219606 | |||||
ISSN | ||||||
収録物識別子タイプ | EISSN | |||||
収録物識別子 | 10897690 | |||||
書誌レコードID | ||||||
収録物識別子タイプ | NCID | |||||
収録物識別子 | AA00694991 | |||||
書誌レコードID | ||||||
収録物識別子タイプ | NCID | |||||
収録物識別子 | AA11868256 | |||||
権利 | ||||||
言語 | en | |||||
権利情報 | Copyright 2000 American Institute of Physics. This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics. The following article appeared in J. Chem. Phys. 112, 6966 (2000) and may be found at http://link.aip.org/link/?jcp/112/6966 | |||||
著者版フラグ | ||||||
出版タイプ | VoR | |||||
出版タイプResource | http://purl.org/coar/version/c_970fb48d4fbd8a85 | |||||
フォーマット | ||||||
内容記述タイプ | Other | |||||
内容記述 | application/pdf |