Published 2002 | Version v1
Book

Study of localization and migration of Ki+Bri- interstitial dipole in KBr lattice

  • 1. Karagandinskij Gosudarstvennyj Univ. im. E.A. Buketova, Karaganda (Kazakhstan)

Description

Processes of localization and migration of Ki+Bri- interstitial dipole in KBr lattice were carried out by the computerized stimulation. Simulation was conducted by the MNDO quantum-chemical method. Clusters consist from 216 ions with accounting of relaxation of 114 ions of the defects surroundings. The computer calculation shows, that the Ki+Bri- dipole is localizing in the crystal lattice due to formation of chemical bond with ions of the neighboring surroundings. In this time the dipole can exists in two forms

Part of:
Proceedings of 7.International conference 'Solid State Physics'

Additional details

Additional titles

Original title (Russian)
Исследование локализации и миграции мэдоузельного диполя К

Publishing Information

Publisher
Vostochno-Kazakhstanskij Gosudarstvennyj Tekhnicheskij Univ.
Imprint Place
Ust-Kamenogorsk (Kazakhstan)
ISBN
9965-615-03-9
Imprint Title
Proceedings of 7.International conference 'Solid State Physics'
Imprint Pagination
366 p.
Journal Page Range
p. 57-59

Conference

Title
7.International conference 'Solid State Physics'
Original Conference Title
7.Mezhdunarodnaya konferentsiya 'Fizika Tverdogo Tela'
Dates
4-7 Jun 2002
Place
Ust-Kamenogorsk (Kazakhstan)

INIS

Country of Publication
Kazakhstan
Country of Input or Organization
Kazakhstan
INIS RN
38057887
Subject category
S36: MATERIALS SCIENCE;
Resource subtype / Literary indicator
Conference
Descriptors DEI
DIPOLES; ENVIRONMENTAL TRANSPORT; INTERSTITIALS; POTASSIUM BROMIDES; SIMULATION
Descriptors DEC
ALKALI METAL COMPOUNDS; BROMIDES; BROMINE COMPOUNDS; CRYSTAL DEFECTS; CRYSTAL STRUCTURE; HALIDES; HALOGEN COMPOUNDS; MASS TRANSFER; MULTIPOLES; POINT DEFECTS; POTASSIUM COMPOUNDS

Optional Information

Notes
8 refs., 2 figs. Imprint:Materialy 7.Mezhdunarodnoj konferentsii 'Fizika Tverdogo Tela'