Результаты исследований: Научные публикации в периодических изданиях › статья › Рецензирование
Electronic structure of fluorite-type crystals. / Evarestov, R. A.; Murin, I. V.; Petrov, A. V.
в: Journal of Physics: Condensed Matter, Том 1, № 37, 008, 1989, стр. 6603-6609.Результаты исследований: Научные публикации в периодических изданиях › статья › Рецензирование
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TY - JOUR
T1 - Electronic structure of fluorite-type crystals
AU - Evarestov, R. A.
AU - Murin, I. V.
AU - Petrov, A. V.
PY - 1989
Y1 - 1989
N2 - The results of the electronic structure calculations made in the large-unit-cell complete neglect of differential overlap approach are given for the crystals MF2 (M=Ca, Sr, Ba, Cd, Pb or Sn) and PbSnF4. The same approach is used for the impurity centre MF2:Cd (M=Ca, Sr, Ba and Pb) and the lattice distortion introduced by the symmetrical shift of the nearest cation neighbour. It is shown that the influence on the band structure of this lattice distortion is not large.
AB - The results of the electronic structure calculations made in the large-unit-cell complete neglect of differential overlap approach are given for the crystals MF2 (M=Ca, Sr, Ba, Cd, Pb or Sn) and PbSnF4. The same approach is used for the impurity centre MF2:Cd (M=Ca, Sr, Ba and Pb) and the lattice distortion introduced by the symmetrical shift of the nearest cation neighbour. It is shown that the influence on the band structure of this lattice distortion is not large.
UR - http://www.scopus.com/inward/record.url?scp=0001415828&partnerID=8YFLogxK
U2 - 10.1088/0953-8984/1/37/008
DO - 10.1088/0953-8984/1/37/008
M3 - Article
AN - SCOPUS:0001415828
VL - 1
SP - 6603
EP - 6609
JO - Journal of Physics Condensed Matter
JF - Journal of Physics Condensed Matter
SN - 0953-8984
IS - 37
M1 - 008
ER -
ID: 84361289