Theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface

The calculations on the electronic and space structure have been carried out for both trimethyl phosphate molecule and that supported at silica surface within the frameworks of the SCF MO LCAO MNDO valence approximation. The routes of these systems destruction have been studied. The decomposition of...

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Дата:2002
Автори: Kukueva, V.V., Kirilov, O.A., Grebenyuk, A.G., Lobanov, V.V.
Формат: Стаття
Мова:English
Опубліковано: Інститут хімії поверхні ім. О.О. Чуйка НАН України 2002
Назва видання:Поверхность
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Онлайн доступ:http://dspace.nbuv.gov.ua/handle/123456789/126363
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Назва журналу:Digital Library of Periodicals of National Academy of Sciences of Ukraine
Цитувати:Theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface / V.V. Kukueva, O.A. Kirilov, A.G. Grebenyuk, V.V. Lobanov // Поверхность. — 2002. — Вип. 7-8. — С. 158-162. — Бібліогр.: 10 назв. — англ.

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Digital Library of Periodicals of National Academy of Sciences of Ukraine
id irk-123456789-126363
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spelling irk-123456789-1263632017-11-21T03:02:39Z Theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface Kukueva, V.V. Kirilov, O.A. Grebenyuk, A.G. Lobanov, V.V. Surface chemistry of silica and related sorbents The calculations on the electronic and space structure have been carried out for both trimethyl phosphate molecule and that supported at silica surface within the frameworks of the SCF MO LCAO MNDO valence approximation. The routes of these systems destruction have been studied. The decomposition of trimethyl phosphate molecule chemically immobilized onto fumed silica surface has been shown to occur with absorption of small heat quantity (~19.1 kcal/mol). This explains a high effectiveness of the use of silicas modified by organic phosphorus derivatives as active components of fire-extinguishing powders. 2002 Article Theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface / V.V. Kukueva, O.A. Kirilov, A.G. Grebenyuk, V.V. Lobanov // Поверхность. — 2002. — Вип. 7-8. — С. 158-162. — Бібліогр.: 10 назв. — англ. XXXX-0106 http://dspace.nbuv.gov.ua/handle/123456789/126363 en Поверхность Інститут хімії поверхні ім. О.О. Чуйка НАН України
institution Digital Library of Periodicals of National Academy of Sciences of Ukraine
collection DSpace DC
language English
topic Surface chemistry of silica and related sorbents
Surface chemistry of silica and related sorbents
spellingShingle Surface chemistry of silica and related sorbents
Surface chemistry of silica and related sorbents
Kukueva, V.V.
Kirilov, O.A.
Grebenyuk, A.G.
Lobanov, V.V.
Theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface
Поверхность
description The calculations on the electronic and space structure have been carried out for both trimethyl phosphate molecule and that supported at silica surface within the frameworks of the SCF MO LCAO MNDO valence approximation. The routes of these systems destruction have been studied. The decomposition of trimethyl phosphate molecule chemically immobilized onto fumed silica surface has been shown to occur with absorption of small heat quantity (~19.1 kcal/mol). This explains a high effectiveness of the use of silicas modified by organic phosphorus derivatives as active components of fire-extinguishing powders.
format Article
author Kukueva, V.V.
Kirilov, O.A.
Grebenyuk, A.G.
Lobanov, V.V.
author_facet Kukueva, V.V.
Kirilov, O.A.
Grebenyuk, A.G.
Lobanov, V.V.
author_sort Kukueva, V.V.
title Theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface
title_short Theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface
title_full Theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface
title_fullStr Theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface
title_full_unstemmed Theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface
title_sort theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface
publisher Інститут хімії поверхні ім. О.О. Чуйка НАН України
publishDate 2002
topic_facet Surface chemistry of silica and related sorbents
url http://dspace.nbuv.gov.ua/handle/123456789/126363
citation_txt Theoretical analysis of thermal destruction of dimethyl phosphates immobilized on dispersed silica surface / V.V. Kukueva, O.A. Kirilov, A.G. Grebenyuk, V.V. Lobanov // Поверхность. — 2002. — Вип. 7-8. — С. 158-162. — Бібліогр.: 10 назв. — англ.
series Поверхность
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AT kirilovoa theoreticalanalysisofthermaldestructionofdimethylphosphatesimmobilizedondispersedsilicasurface
AT grebenyukag theoreticalanalysisofthermaldestructionofdimethylphosphatesimmobilizedondispersedsilicasurface
AT lobanovvv theoreticalanalysisofthermaldestructionofdimethylphosphatesimmobilizedondispersedsilicasurface
first_indexed 2023-10-18T20:50:39Z
last_indexed 2023-10-18T20:50:39Z
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