The DOI matches its Crossref record; 1 of the 1 references it cites were found in a registry or an index.
Electron Donation in the Water–Water Hydrogen Bond
Abstract
Donation is not from an sp3 orbital: Decomposition analysis, based on absolutely localized molecular orbitals, provides an alternative and somewhat unconventional view of hydrogen bonding in the water dimer. A new description of the electron-donating orbital is uncovered: unlike sp3 lone pairs, a single donor–acceptor orbital pair forms, in which the donating orbital changes its orientation according to the relative positions of the two molecules.
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Citations
Cites
Tetrahedral structure or chains for liquid water
Head-Gordon, T., & Johnson, M. E. (2006) · Proceedings of the National Academy of Sciences · doi:10.1073/pnas.0510593103 · Cited by 265
Cited by
What Is the Covalency of Hydrogen Bonding?
Grabowski, S. J. (2011) · Chemical Reviews · doi:10.1021/cr800346f · Cited by 1,285
σ-Hole Bond vs π-Hole Bond: A Comparison Based on Halogen Bond
Wang, H., Wang, W., & Jin, W. J. (2016) · Chemical Reviews · doi:10.1021/acs.chemrev.5b00527 · Cited by 631
The Orientation and Charge of Water at the Hydrophobic Oil Droplet–Water Interface
Vácha, R., Rick, S. W., Jungwirth, P., de Beer, A. G. F., de Aguiar, H. B., Samson, J.-S., & Roke, S. (2011) · Journal of the American Chemical Society · doi:10.1021/ja202081x · Cited by 278
Metadata
- Authors
- Khaliullin, R. Z., Bell, A. T., & Head‐Gordon, M.
- Venue
- Chemistry – A European Journal
- Publisher
- Wiley
- Published
- 2009-01-05
- Volume
- 15
- Issue
- 4
- Pages
- 851-855
- ISSN
- 0947-6539 (ISSN-L)
- 1521-3765
- OpenAlex
- W1987529755
- Cited by
- 158
- References
- 1
- FWCI
- 6.09
- Type
- journal article
- Language
- en
- Open access
- closed
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- Khaliullin, R. Z., Bell, A. T., & Head‐Gordon, M. (2009). Electron Donation in the Water–Water Hydrogen Bond. Chemistry – A European Journal. https://doi.org/10.1002/chem.200802107
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