23Na NMR in binary lithium-sodium cobaltite / Kellerman D.G., Zhuravlev N.A., Semenova A.S., Shein I.R., Kuznetsov M.V. // Bulletin of the Russian Academy of Sciences: Physics. - 2011. - V. 75, l. 8. - P. 1157-1159.

ISSN:

10628738

Type:

Article

Abstract:

Li0.48Na0.35CoO2 lithium-sodium cobaltite was studied by means of wide-line 23Na and 7Li NMR. A series of quantum-chemical calculations allowed to us determine the optimum positions of Li and Na atoms, to construct a map of the densities of electronic states near the Fermi level, and to estimate the electric field gradient on the Na nuclei. The results from these calculations are compared with experimental data from NMR and X-ray photoelectron spectroscopy © 2011 Allerton Press, Inc.

Author keywords:

Index keywords:

Electric field gradients; Experimental data; Na atoms; NMR and X-ray; Optimum position; Quantum-chemical calculation; Cobalt compounds; Electric fields; Lithium; Photoelectron spectroscopy; Quantum ch

DOI:

10.3103/S1062873811050236

Смотреть в Scopus:

https://www.scopus.com/inward/record.uri?eid=2-s2.0-80054755382&doi=10.3103%2fS1062873811050236&partnerID=40&md5=5d9d47f0c0c235c67c1178c12ff8bcc7

Соавторы в МНС:

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Другие поля

Поле	Значение
Link	https://www.scopus.com/inward/record.uri?eid=2-s2.0-80054755382&doi=10.3103%2fS1062873811050236&partnerID=40&md5=5d9d47f0c0c235c67c1178c12ff8bcc7
Affiliations	Institute of Solid State Chemistry, Urals Branch, Russian Academy of Sciences, Yekaterinburg 620219, Russian Federation
References	Shevel'Kov, A.V., (2008) Usp. Khim., 77 (1), p. 3; Galakhov, V.R., (2002) Fiz. Tverd. Tela, 44 (2), p. 257; Balsys, R.J., Davis, R.L., (1994) Solid State Ionics, 69, p. 69. , 10.1016/0167-2738(94)90451-0; Zhi, R., (2006) J. Phys.: Condens. Matter, 18, p. 379; Perdew, J.P., Burke, S., Ernzerhof, M., (1996) Phys. Rev. Lett., 77 (8), p. 3865. , 1996PhRvL.77.3865P 10.1103/PhysRevLett.77.3865; Blochl, P.E., Jepsen, O., Anderson, O.K., (1994) Phys. Rev. B, 49 (23), p. 16223. , 1994PhRvB.4916223B 10.1103/PhysRevB.49.16223; Abragam, A., (1961) The Principles of Nuclear Magnetism, , Clarendon Press Oxford
Correspondence Address	Kellerman, D.G.; Institute of Solid State Chemistry, Urals Branch, Russian Academy of Sciences, Yekaterinburg 620219, Russian Federation
Language of Original Document	English
Abbreviated Source Title	Bull. Russ. Acad. Sci. Phys.
Source	Scopus