Ab initio model potential study of environmental effects on the Jahn–Teller parameters of Cu2+ and Ag2+ impurities in MgO, CaO, and SrO hosts

Pascual, José Luis; Seijo, Luis; Barandiarán, Zoila

UAM_Biblioteca

Author

Pascual, José Luis; Seijo, Luis; Barandiarán, Zoila

Publisher

American Institute of Physics

Date

1993

Citation

Journal of Chemical Physics 98.12 (1993): 9715-9724

ISSN

0021-9606

DOI

10.1063/1.464350

Editor's Version

http://dx.doi.org/10.1063/1.464350

Subjects

Química cuántica; Cristalografía; Química

URI

http://hdl.handle.net/10486/7291

Rights

Copyright (1993) American Institute of Physics. This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics. The following article prepared in (Pascual, J.L.; Sejo, K. and Z. Barandiaran. "Ab initio model potential study of environmental effects on the Jahn–Teller parameters of Cu2+ and Ag2+ impurities in MgO, CaO, and SrO hosts." Journal of Chemical Physics 98.12 (1993): 9715-9724) and may be found at http://jcp.aip.org/resource/1/jcpsa6/v98/i12/p9715_s1

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