SIMULATION OF ELECTRONIC AND MAGNETIC PROPERTIES OF LOW-DIMENSIONAL MATERIALS WITH USE OF FIRST PRINCIPLES METHODS
Abstract
The result of electronic and magnetic properties investigation of ZnO granular films and quasi-two-dimensional structures of TiS2 and TiSe2 were presented. Quantum-mechanical approach in software package VASP was used during the calculation procedure, in particular the method of augmented plane wave (PAW-method). The values of the electronic states’ density of the compounds were presented, the distribution of the magnetic density of ZnO granular films were shown.
About the Authors
M. S. Zelenina
Белорусский государственный университет информатики и радиоэлектроники
Belarus
Belarus
O. A. Kozlova
Белорусский государственный университет информатики и радиоэлектроники
Belarus
Belarus
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Review
For citations:
Zelenina M.S., Kozlova O.A. SIMULATION OF ELECTRONIC AND MAGNETIC PROPERTIES OF LOW-DIMENSIONAL MATERIALS WITH USE OF FIRST PRINCIPLES METHODS. Doklady BGUIR. 2014;(8):18-23. (In Russ.)
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