A simplified empirical model for approximation of the `bond valence-bond length' correlation for H-O bonds

The `bond valence (s)–bond length (r)' correlation reported earlier for H—O bonds [Brown (2009). Chem. Rev.109, 6858–6919] has been closely approximated using the function s = (α−βr)1/γ, where α = 1.185 (10), β = 0.321 (8) and γ = 0.36.

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Bibliographic Details
Published inActa crystallographica. Section B, Structural science Vol. 67; no. 3; pp. 263 - 265
Main Author Sidey, Vasyl
Format Journal Article
LanguageEnglish
Published 5 Abbey Square, Chester, Cheshire CH1 2HU, England International Union of Crystallography 01.06.2011
Blackwell Publishing Ltd
Subjects
Approximation
bond-valence model
Bonding
Correlation
Correlation analysis
Crystallography
Empirical analysis
hydrogen bonding
Hydrogen bonds
Mathematical analysis
Mathematical models
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Summary:The `bond valence (s)–bond length (r)' correlation reported earlier for H—O bonds [Brown (2009). Chem. Rev.109, 6858–6919] has been closely approximated using the function s = (α−βr)1/γ, where α = 1.185 (10), β = 0.321 (8) and γ = 0.36.
Bibliography:ark:/67375/WNG-541M6FW8-R
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ArticleID:AYBKD5049
ObjectType-Article-1
SourceType-Scholarly Journals-1
ObjectType-Feature-2
content type line 23
ISSN:0108-7681
2052-5192
1600-5740
2052-5206
DOI:10.1107/S0108768111010408