The Electronic Structure of Crystalline Lead Oxides : II. Chemical Bonding in the Crystalline Lead Oxides
(1991) In Physica Status Solidi (B) 165(2). p.411-418- Abstract
A quantum‐chemical definition is proposed of the full atomic valence taking into account both, covalent and ionic components of chemical bonds formed by an atom in molecules or crystals. Atomic charges, covalent bond orders, and full atomic valencies of lead and oxygen atoms in the crystalline lead oxides are calculated in the framework of the LUC‐CNDO approach.
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https://lup.lub.lu.se/record/6bc336f5-1072-4370-9465-74b18b191d09
- author
- Evarestov, R. A. and Veryazov, V. A. LU
- publishing date
- 1991-01-01
- type
- Contribution to journal
- publication status
- published
- subject
- in
- Physica Status Solidi (B)
- volume
- 165
- issue
- 2
- pages
- 8 pages
- publisher
- John Wiley & Sons Inc.
- external identifiers
-
- scopus:84987084471
- ISSN
- 0370-1972
- DOI
- 10.1002/pssb.2221650211
- language
- English
- LU publication?
- no
- id
- 6bc336f5-1072-4370-9465-74b18b191d09
- date added to LUP
- 2019-05-22 14:35:34
- date last changed
- 2021-01-03 10:17:57
@article{6bc336f5-1072-4370-9465-74b18b191d09, abstract = {{<p>A quantum‐chemical definition is proposed of the full atomic valence taking into account both, covalent and ionic components of chemical bonds formed by an atom in molecules or crystals. Atomic charges, covalent bond orders, and full atomic valencies of lead and oxygen atoms in the crystalline lead oxides are calculated in the framework of the LUC‐CNDO approach.</p>}}, author = {{Evarestov, R. A. and Veryazov, V. A.}}, issn = {{0370-1972}}, language = {{eng}}, month = {{01}}, number = {{2}}, pages = {{411--418}}, publisher = {{John Wiley & Sons Inc.}}, series = {{Physica Status Solidi (B)}}, title = {{The Electronic Structure of Crystalline Lead Oxides : II. Chemical Bonding in the Crystalline Lead Oxides}}, url = {{http://dx.doi.org/10.1002/pssb.2221650211}}, doi = {{10.1002/pssb.2221650211}}, volume = {{165}}, year = {{1991}}, }