The electronic structure of crystalline nickel oxides
(1994) In Journal of Electron Spectroscopy and Related Phenomena 68(C). p.555-563- Abstract
The electronic structure of eleven crystalline nickel oxides was investigated by band theory - CNDO method. Both the band and local properties of the electronic structure were calculated and were used for the description of chemical bonding in Ni(II) (NiO, Li2NiO2, Na2NiO2, K2NiO2, BaNiO2, La2NiO4), Ni(III) (LiNiO2, NaNiO2, LaNiO3) and Ni(IV) (BaNiO3) compounds.
Please use this url to cite or link to this publication:
https://lup.lub.lu.se/record/dd604200-3fed-461b-af4a-13f6454e41c7
- author
- Evarestov, R. A. ; Veryazov, V. A. LU ; Tupitsyn, I. I. and Afanasiev, V. V.
- publishing date
- 1994-05-06
- type
- Contribution to journal
- publication status
- published
- subject
- in
- Journal of Electron Spectroscopy and Related Phenomena
- volume
- 68
- issue
- C
- pages
- 9 pages
- publisher
- Elsevier
- external identifiers
-
- scopus:0001691750
- ISSN
- 0368-2048
- DOI
- 10.1016/0368-2048(94)80021-9
- language
- English
- LU publication?
- no
- id
- dd604200-3fed-461b-af4a-13f6454e41c7
- date added to LUP
- 2019-05-22 14:34:13
- date last changed
- 2021-01-17 03:37:40
@article{dd604200-3fed-461b-af4a-13f6454e41c7, abstract = {{<p>The electronic structure of eleven crystalline nickel oxides was investigated by band theory - CNDO method. Both the band and local properties of the electronic structure were calculated and were used for the description of chemical bonding in Ni(II) (NiO, Li<sub>2</sub>NiO<sub>2</sub>, Na<sub>2</sub>NiO<sub>2</sub>, K<sub>2</sub>NiO<sub>2</sub>, BaNiO<sub>2</sub>, La<sub>2</sub>NiO<sub>4</sub>), Ni(III) (LiNiO<sub>2</sub>, NaNiO<sub>2</sub>, LaNiO<sub>3</sub>) and Ni(IV) (BaNiO<sub>3</sub>) compounds.</p>}}, author = {{Evarestov, R. A. and Veryazov, V. A. and Tupitsyn, I. I. and Afanasiev, V. V.}}, issn = {{0368-2048}}, language = {{eng}}, month = {{05}}, number = {{C}}, pages = {{555--563}}, publisher = {{Elsevier}}, series = {{Journal of Electron Spectroscopy and Related Phenomena}}, title = {{The electronic structure of crystalline nickel oxides}}, url = {{http://dx.doi.org/10.1016/0368-2048(94)80021-9}}, doi = {{10.1016/0368-2048(94)80021-9}}, volume = {{68}}, year = {{1994}}, }