Electron structure of diborides of 3d metals

Autor:	G. G. Kvachantiradze, P. D. Kervalishvili, N. V. Ushakova, G. E. Grechnev, K. S. Kharebov
Předmět:	Materials science Physics and Astronomy (miscellaneous) Ab initio quantum chemistry methods Condensed Matter::Superconductivity Binding energy Ab initio General Physics and Astronomy Thermodynamics Electron Electronic band structure Magnetic susceptibility Heat capacity Spectral line
Zdroj:	Scopus-Elsevier
Popis:	The electron energy spectra of diborides of 3d-metals ScB2, TiB2, VB2, CrB2, and MnB2 are calculated ab initio. Thermodynamic properties and stability of these compounds are investigated at low temperatures. An analysis of the low-temperature heat capacity and magnetic properties of diborides has made it possible to establish a number of parameters of many-particle interactions.
Databáze:	OpenAIRE
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