MOLECULAR DYNAMICS STUDY OF SIZE DEPENDENCES OF MELTING AND CRYSTALLIZATION HEATS OF PLATINUM AND PALLADIUM NANOCLUSTERS
On the basis of the molecular dynamics results obtained by using the tight binding potential, the heats of melting, crystallization, and also the sublimation and evaporation heats of platinum and palladium nanoclusters were found. The obtained size dependences are linear if the inverse radius is cho...
| Main Authors: | , , , , |
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| Format: | Article |
| Language: | Russian |
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Tver State University
2019-12-01
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| Series: | Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов |
| Subjects: | |
| Online Access: | https://physchemaspects.ru/2019/doi-10-26456-pcascnn-2019-11-436/?lang=en |
| _version_ | 1811309994259251200 |
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| author | S.A. Vasilyev A.A. Romanov N.V. Vostrov V.L. Skopich K.G. Savina |
| author_facet | S.A. Vasilyev A.A. Romanov N.V. Vostrov V.L. Skopich K.G. Savina |
| author_sort | S.A. Vasilyev |
| collection | DOAJ |
| description | On the basis of the molecular dynamics results obtained by using the tight binding potential, the heats of melting, crystallization, and also the sublimation and evaporation heats of platinum and palladium nanoclusters were found. The obtained size dependences are linear if the inverse radius is chosen as an argument, which allows extrapolating the dependencies to the corresponding bulk phases and comparing with the tabulated values. |
| first_indexed | 2024-04-13T09:51:56Z |
| format | Article |
| id | doaj.art-6cc35a0411fe46f2b308b23766da2e5e |
| institution | Directory Open Access Journal |
| issn | 2226-4442 2658-4360 |
| language | Russian |
| last_indexed | 2024-04-13T09:51:56Z |
| publishDate | 2019-12-01 |
| publisher | Tver State University |
| record_format | Article |
| series | Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов |
| spelling | doaj.art-6cc35a0411fe46f2b308b23766da2e5e2022-12-22T02:51:34ZrusTver State UniversityФизико-химические аспекты изучения кластеров, наноструктур и наноматериалов2226-44422658-43602019-12-011143644210.26456/pcascnn/2019.11.436MOLECULAR DYNAMICS STUDY OF SIZE DEPENDENCES OF MELTING AND CRYSTALLIZATION HEATS OF PLATINUM AND PALLADIUM NANOCLUSTERSS.A. Vasilyev0A.A. Romanov1N.V. Vostrov2V.L. Skopich3K.G. Savina4Tver State University, Tver, RussiaTver State University, Tver, RussiaTver State University, Tver, RussiaTver State University, Tver, RussiaTver State University, Tver, RussiaOn the basis of the molecular dynamics results obtained by using the tight binding potential, the heats of melting, crystallization, and also the sublimation and evaporation heats of platinum and palladium nanoclusters were found. The obtained size dependences are linear if the inverse radius is chosen as an argument, which allows extrapolating the dependencies to the corresponding bulk phases and comparing with the tabulated values.https://physchemaspects.ru/2019/doi-10-26456-pcascnn-2019-11-436/?lang=enplatinum nanoclusterspalladium nanoclustersmolecular dynamics; tight binding potentialheat of meltingheat of crystallizationheat of sublimationheat of evaporation |
| spellingShingle | S.A. Vasilyev A.A. Romanov N.V. Vostrov V.L. Skopich K.G. Savina MOLECULAR DYNAMICS STUDY OF SIZE DEPENDENCES OF MELTING AND CRYSTALLIZATION HEATS OF PLATINUM AND PALLADIUM NANOCLUSTERS Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов platinum nanoclusters palladium nanoclusters molecular dynamics; tight binding potential heat of melting heat of crystallization heat of sublimation heat of evaporation |
| title | MOLECULAR DYNAMICS STUDY OF SIZE DEPENDENCES OF MELTING AND CRYSTALLIZATION HEATS OF PLATINUM AND PALLADIUM NANOCLUSTERS |
| title_full | MOLECULAR DYNAMICS STUDY OF SIZE DEPENDENCES OF MELTING AND CRYSTALLIZATION HEATS OF PLATINUM AND PALLADIUM NANOCLUSTERS |
| title_fullStr | MOLECULAR DYNAMICS STUDY OF SIZE DEPENDENCES OF MELTING AND CRYSTALLIZATION HEATS OF PLATINUM AND PALLADIUM NANOCLUSTERS |
| title_full_unstemmed | MOLECULAR DYNAMICS STUDY OF SIZE DEPENDENCES OF MELTING AND CRYSTALLIZATION HEATS OF PLATINUM AND PALLADIUM NANOCLUSTERS |
| title_short | MOLECULAR DYNAMICS STUDY OF SIZE DEPENDENCES OF MELTING AND CRYSTALLIZATION HEATS OF PLATINUM AND PALLADIUM NANOCLUSTERS |
| title_sort | molecular dynamics study of size dependences of melting and crystallization heats of platinum and palladium nanoclusters |
| topic | platinum nanoclusters palladium nanoclusters molecular dynamics; tight binding potential heat of melting heat of crystallization heat of sublimation heat of evaporation |
| url | https://physchemaspects.ru/2019/doi-10-26456-pcascnn-2019-11-436/?lang=en |
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