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  • Teoretický postup k určení distribuční funkce v nehomogenním systémů tuhých koulí u planární stěny, ( založený na stanovení korelační funkce pozadí z rozdílu residuálních chemických potenciálů tuhé částice, tuhé stěny a odpovídejícího kombin- vaného tělesa) je rozšířen na nehomogenní systémy tvořené tuhými dumbely (HD) a tuhými triatomiky.(HT). Jsou uvažovány kolmé a paralelní orientace jak HD tak HT vzhledem k tuhé stěně a ukázán způsob určení residuálního chemického potenciálu na základě geometrických veličin ? objemu, povrchu a integrálu střední křivosti, dělenému 4 pi, pro tuhou částici, tuhou stěnu a kombinované těleso.Byly studovány nehomogenní systémy tuhá stěna + tuhý dumbel se site-site vzdáleností L = 0.6 a redukovanou hustotou rho=0.491 a tuhá stěna + tuhý triatomik s L=1.6 a zlomkem stěsnání y=0.409 a získané distribuční funkce porovnány se simulačními daty. Byl nalezen dobrý souhlas v nejdůležitějším oboru vzdáleností. (cs)
  • An extension of the theoretical approach to determine the distribution function in the inhomogeneous systems of hard spheres near a planar hard wall (based on the evaluation of the background correlation function in terms of the residual chemical potentials of the hard particle, hard wall and the corresponding combined body) is extended to inhomogeneous systems of hard dumbbells (HD) and hard triatomics (HT). The perpendicular and parallel orientations of both HD and HT with respect to the hard wall are considered and the way of the evaluation of the residual chemical potentials in terms of the geometric quantities - a volume, surface area and the mean curvature integral, divided by 4$\pi$, of a particle, hard wall and the corresponding combined body is outlined. The inhomogeneous systems hard wall + hard dumbbell with the site-site distance L = 0.6 and reduced density rho = 0.491 and hard wall + hard triatomics with L= 1.6 and packing fraction y=0.409 are studied and the obtained dist
  • An extension of the theoretical approach to determine the distribution function in the inhomogeneous systems of hard spheres near a planar hard wall (based on the evaluation of the background correlation function in terms of the residual chemical potentials of the hard particle, hard wall and the corresponding combined body) is extended to inhomogeneous systems of hard dumbbells (HD) and hard triatomics (HT). The perpendicular and parallel orientations of both HD and HT with respect to the hard wall are considered and the way of the evaluation of the residual chemical potentials in terms of the geometric quantities - a volume, surface area and the mean curvature integral, divided by 4$\pi$, of a particle, hard wall and the corresponding combined body is outlined. The inhomogeneous systems hard wall + hard dumbbell with the site-site distance L = 0.6 and reduced density rho = 0.491 and hard wall + hard triatomics with L= 1.6 and packing fraction y=0.409 are studied and the obtained dist (en)
Title
  • Distribution functions in systems of hard dumbbells and linear hard triatomics near a hard wall
  • Distribuční funkce v systémech tuhých dumbelů a lineárních triatomiků u tuhé stěny. (cs)
  • Distribution functions in systems of hard dumbbells and linear hard triatomics near a hard wall (en)
skos:prefLabel
  • Distribution functions in systems of hard dumbbells and linear hard triatomics near a hard wall
  • Distribuční funkce v systémech tuhých dumbelů a lineárních triatomiků u tuhé stěny. (cs)
  • Distribution functions in systems of hard dumbbells and linear hard triatomics near a hard wall (en)
skos:notation
  • RIV/44555601:13440/08:00004183!RIV09-AV0-13440___
http://linked.open...avai/riv/aktivita
http://linked.open...avai/riv/aktivity
  • P(IAA400720710)
http://linked.open...iv/cisloPeriodika
  • 48
http://linked.open...vai/riv/dodaniDat
http://linked.open...aciTvurceVysledku
http://linked.open.../riv/druhVysledku
http://linked.open...iv/duvernostUdaju
http://linked.open...titaPredkladatele
http://linked.open...dnocenehoVysledku
  • 363892
http://linked.open...ai/riv/idVysledku
  • RIV/44555601:13440/08:00004183
http://linked.open...riv/jazykVysledku
http://linked.open.../riv/klicovaSlova
  • distribution function; background function; chem. potential; inhomogeneous systém; hard dumbbell; hard triatomics; volume; surface area; mean curvature integral (en)
http://linked.open.../riv/klicoveSlovo
http://linked.open...odStatuVydavatele
  • US - Spojené státy americké
http://linked.open...ontrolniKodProRIV
  • [DFBC2BB361DE]
http://linked.open...i/riv/nazevZdroje
  • Journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical
http://linked.open...in/vavai/riv/obor
http://linked.open...ichTvurcuVysledku
http://linked.open...cetTvurcuVysledku
http://linked.open...vavai/riv/projekt
http://linked.open...UplatneniVysledku
http://linked.open...iv/tvurceVysledku
  • Boublík, Tomáš
http://linked.open...ain/vavai/riv/wos
  • 000261218200019
issn
  • 1520-6106
number of pages
http://localhost/t...ganizacniJednotka
  • 13440
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