Published 2012 | Version v1
Journal article

Electronic structure peculiarities of the solid solutions of transition metals in Cr

  • 1. Taras Shevchenko National University of Kyiv, Kyiv (Ukraine)

Description

Electronic structures of the solid solutions of transition metals (Ti, V, Mn, Fe, Co, Ni, Cu; Nb, Mo; Ta, W) in Cr have been investigated using the LMTO (linear muffin-tin orbital) calculation method. The energy dependences of the density of electronic states have been calculated for the supercell containing 16 atoms. It is shown that the doping with transition metals leads to the splitting of the chromium main 3d-peak into two sub-bands due to the formation of charge density waves. It is proved that the nesting model is not applicable the considered Cr alloys.

Additional details

Additional titles

Original title (Ukrainian)
Osoblivostyi elektronnoyi strukturi tverdikh rozchinyiv perekhyidnikh metalyiv u khromyi

Publishing Information

Journal Title
Dopovyidyi Natsyional'noyi Akademyiyi Nauk Ukrayini
Journal Issue
no.6
Journal Page Range
p. 84-88
ISSN
1025-6415