The DOI matches its Crossref record; 18 of the 18 references it cites were found in a registry or an index.
Tetracoordinated Planar Carbon in the Al4C-Anion. A Combined Photoelectron Spectroscopy and ab Initio Study
Abstract
The chemical structure and bonding of Al 4 C and Al 4 C - have been studied by photoelectron spectroscopy and ab initio calculations. While Al 4 C is known to be a tetrahedral molecule, the data reported here suggest that Al 4 C - has D 4 h symmetry (when averaged over zero-point vibrational motions) and thus is the smallest species identified to date that contains a tetracoordinated planar carbon atom. The experimental vertical electron detachment energy of Al 4 C - (2.65 ± 0.06 eV) compares well to 2.71 eV calculated at the CCSD(T)/6-311+G(2df) level of theory. The excellent agreement between the calculated and experimental electron detachment energies, excitation energies, and other spectral features allows us to elucidate the structure of the tetracoordinated planar-carbon-containing Al 4 C - anion.
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Atomic and Molecular Electron Affinities: Photoelectron Experiments and Theoretical Computations
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Simons, J. (2008) · The Journal of Physical Chemistry A · doi:10.1021/jp711490b · Cited by 417
Self-citationWang, Y., Li, F., Li, Y., & Chen, Z. (2016) · Nature Communications · doi:10.1038/ncomms11488 · Cited by 328
Planar Hexacoordinate Carbon: A Viable Possibility
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Zhai, H.-J., Wang, L.-S., Alexandrova, A. N., & Boldyrev, A. I. (2002) · The Journal of Chemical Physics · doi:10.1063/1.1511184 · Cited by 253
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Metadata
- Authors
- Li, X., Wang, L.-S., Boldyrev, A. I., & Simons, J.
- Venue
- Journal of the American Chemical Society
- Publisher
- American Chemical Society (ACS)
- Published
- 1999-06-01
- Volume
- 121
- Issue
- 25
- Pages
- 6033-6038
- ISSN
- 0002-7863 (ISSN-L)
- 1520-5126
- OpenAlex
- W2949189255
- Cited by
- 355
- References
- 18
- FWCI
- 5.84
- Type
- journal article
- Language
- en
- Open access
- closed
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