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Application of embedded-cluster models in the theory of local centres in graphite. / Evarestov, R. A.; Sokolov, A. R.; Leko, A. V.; Verjazov, V. A.

в: Journal of Physics: Condensed Matter, Том 1, № 37, 009, 1989, стр. 6611-6623.

Результаты исследований: Научные публикации в периодических изданиях › статья › Рецензирование

Harvard

Evarestov, RA, Sokolov, AR, Leko, AV & Verjazov, VA 1989, 'Application of embedded-cluster models in the theory of local centres in graphite', Journal of Physics: Condensed Matter, Том. 1, № 37, 009, стр. 6611-6623. https://doi.org/10.1088/0953-8984/1/37/009

APA

Evarestov, R. A., Sokolov, A. R., Leko, A. V., & Verjazov, V. A. (1989). Application of embedded-cluster models in the theory of local centres in graphite. Journal of Physics: Condensed Matter, 1(37), 6611-6623. [009]. https://doi.org/10.1088/0953-8984/1/37/009

Vancouver

Evarestov RA, Sokolov AR, Leko AV, Verjazov VA. Application of embedded-cluster models in the theory of local centres in graphite. Journal of Physics: Condensed Matter. 1989;1(37):6611-6623. 009. https://doi.org/10.1088/0953-8984/1/37/009

Author

Evarestov, R. A. ; Sokolov, A. R. ; Leko, A. V. ; Verjazov, V. A. / Application of embedded-cluster models in the theory of local centres in graphite. в: Journal of Physics: Condensed Matter. 1989 ; Том 1, № 37. стр. 6611-6623.

BibTeX

@article{ea560e94fdcd46e483e6accdb58e77b7,
title = "Application of embedded-cluster models in the theory of local centres in graphite",
abstract = "Different approaches to the theoretical study of the local centres in solids are discussed. Particular attention is paid to the embedded-cluster models. There are given the mathematical formulation, the computational scheme and applications for some local centres on/in graphite monolayers of the moderately large embedded cluster and the large-unit-cell-embedded-cluster (LUC-EC) models. It is shown that both models are based on related approximation and give comparable results for the centres considered. At the same time the LUC-EC scheme is, in practice, realised more easily and enables one to study the charged centres. A study of some charged states of adsorbed hydrogen and substitutional boron and nitrogen atoms on/in graphite monolayers is used to illustrate the LUC-EC model applications.",
author = "Evarestov, {R. A.} and Sokolov, {A. R.} and Leko, {A. V.} and Verjazov, {V. A.}",
year = "1989",
doi = "10.1088/0953-8984/1/37/009",
language = "English",
volume = "1",
pages = "6611--6623",
journal = "Journal of Physics Condensed Matter",
issn = "0953-8984",
publisher = "IOP Publishing Ltd.",
number = "37",

}

RIS

TY - JOUR

T1 - Application of embedded-cluster models in the theory of local centres in graphite

AU - Evarestov, R. A.

AU - Sokolov, A. R.

AU - Leko, A. V.

AU - Verjazov, V. A.

PY - 1989

Y1 - 1989

N2 - Different approaches to the theoretical study of the local centres in solids are discussed. Particular attention is paid to the embedded-cluster models. There are given the mathematical formulation, the computational scheme and applications for some local centres on/in graphite monolayers of the moderately large embedded cluster and the large-unit-cell-embedded-cluster (LUC-EC) models. It is shown that both models are based on related approximation and give comparable results for the centres considered. At the same time the LUC-EC scheme is, in practice, realised more easily and enables one to study the charged centres. A study of some charged states of adsorbed hydrogen and substitutional boron and nitrogen atoms on/in graphite monolayers is used to illustrate the LUC-EC model applications.

AB - Different approaches to the theoretical study of the local centres in solids are discussed. Particular attention is paid to the embedded-cluster models. There are given the mathematical formulation, the computational scheme and applications for some local centres on/in graphite monolayers of the moderately large embedded cluster and the large-unit-cell-embedded-cluster (LUC-EC) models. It is shown that both models are based on related approximation and give comparable results for the centres considered. At the same time the LUC-EC scheme is, in practice, realised more easily and enables one to study the charged centres. A study of some charged states of adsorbed hydrogen and substitutional boron and nitrogen atoms on/in graphite monolayers is used to illustrate the LUC-EC model applications.

UR - http://www.scopus.com/inward/record.url?scp=36149031401&partnerID=8YFLogxK

U2 - 10.1088/0953-8984/1/37/009

DO - 10.1088/0953-8984/1/37/009

M3 - Article

AN - SCOPUS:36149031401

VL - 1

SP - 6611

EP - 6623

JO - Journal of Physics Condensed Matter

JF - Journal of Physics Condensed Matter

SN - 0953-8984

IS - 37

M1 - 009

ER -

ID: 84360929