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  • Adhesion of silver nanoparticles on the kaolinite substrate was investigated using molecular modeling (force field calculations).Modeling revealed the preferred orientation of silver nanoparticles on the silicate substrate and showed the strong dependence of total energy and stability of nanocomposite structure on two factors: (1) the mutual orientation of nanoparticle and substrate structure and (2) the size and thickness of the nanoparticle. The size of Ag single crystalline domains calculated by modeling was in good agreement with the experimental observations (HRTEM). Molecular modeling in confrontation with HRTEM analysis showed the prediction possibility as to the nanoparticles structure and stability of silver/kaolinite nanocomposite.
  • Adhesion of silver nanoparticles on the kaolinite substrate was investigated using molecular modeling (force field calculations).Modeling revealed the preferred orientation of silver nanoparticles on the silicate substrate and showed the strong dependence of total energy and stability of nanocomposite structure on two factors: (1) the mutual orientation of nanoparticle and substrate structure and (2) the size and thickness of the nanoparticle. The size of Ag single crystalline domains calculated by modeling was in good agreement with the experimental observations (HRTEM). Molecular modeling in confrontation with HRTEM analysis showed the prediction possibility as to the nanoparticles structure and stability of silver/kaolinite nanocomposite. (en)
Title
  • Modeling of silver nanoparticles anchored on the silicate substrate
  • Modeling of silver nanoparticles anchored on the silicate substrate (en)
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  • Modeling of silver nanoparticles anchored on the silicate substrate
  • Modeling of silver nanoparticles anchored on the silicate substrate (en)
skos:notation
  • RIV/61989100:27640/08:00019814!RIV10-GA0-27640___
http://linked.open...avai/riv/aktivita
http://linked.open...avai/riv/aktivity
  • P(GA205/08/0869), Z(MSM6198910016)
http://linked.open...vai/riv/dodaniDat
http://linked.open...aciTvurceVysledku
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  • 379893
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  • RIV/61989100:27640/08:00019814
http://linked.open...riv/jazykVysledku
http://linked.open.../riv/klicovaSlova
  • molecular modeling; adhesion; kaolinite; silver; nanoparticle (en)
http://linked.open.../riv/klicoveSlovo
http://linked.open...ontrolniKodProRIV
  • [4911167312BB]
http://linked.open...i/riv/mistoVydani
  • Ostrava
http://linked.open...i/riv/nazevZdroje
  • Annual Proceedings of Science and Technology at VŠB-TUO
http://linked.open...in/vavai/riv/obor
http://linked.open...ichTvurcuVysledku
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  • Klemm, V.
  • Rafaja, D.
  • Čapková, Pavla
  • Tokarský, Jonáš
http://linked.open...n/vavai/riv/zamer
number of pages
http://purl.org/ne...btex#hasPublisher
  • Vysoká škola báňská - Technická univerzita Ostrava
https://schema.org/isbn
  • 978-80-248-1863-4
http://localhost/t...ganizacniJednotka
  • 27640
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