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Molecular modeling and simulations

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F44555601%3A13440%2F16%3A43887799" target="_blank" >RIV/44555601:13440/16:43887799 - isvavai.cz</a>

  • Alternative codes found

    RIV/67985858:_____/17:00473174

  • Result on the web

    <a href="http://dx.doi.org/10.1016/B978-0-08-100907-9.00011-8" target="_blank" >http://dx.doi.org/10.1016/B978-0-08-100907-9.00011-8</a>

  • DOI - Digital Object Identifier

    <a href="http://dx.doi.org/10.1016/B978-0-08-100907-9.00011-8" target="_blank" >10.1016/B978-0-08-100907-9.00011-8</a>

Alternative languages

  • Result language

    angličtina

  • Original language name

    Molecular modeling and simulations

  • Original language description

    From the viewpoint of physics and chemistry, we deal with the problem of a solution -- made up of a solvent (typically, but not necessarily, water), omnipresent ions, and polymer molecules -- subjected to a strong external electric field. Switching on the electric field perpendicular to the solution surface does not necessarily induce the desired jetting (mesoscopic formation). There are four potential scenarios: Either nothing happens (regardless of the strength of the field) or the liquid leaves the solution in the form of spray (drops), jet, or stream. Only stable jetting leads to the production of nanofibers and the ultimate goal of molecular simulations is to locate the window in the multidimensional parameter space where jetting occurs. Furthermore, when a jet erupts from a Taylor cone it need not remain stable. It may disintegrate into drops and an evident further question to answer is when and why this occurs, which is again a task for molecular simulations.

  • Czech name

  • Czech description

Classification

  • Type

    C - Chapter in a specialist book

  • CEP classification

    CF - Physical chemistry and theoretical chemistry

  • OECD FORD branch

Result continuities

  • Project

    <a href="/en/project/GAP208%2F12%2F0105" target="_blank" >GAP208/12/0105: POLYMER SOLUTIONS IN AN EXTERNAL FIELD: MOLECULAR UNDERSTANDING OF ELECTROSPINNING</a><br>

  • Continuities

    P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)

Others

  • Publication year

    2016

  • Confidentiality

    S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Data specific for result type

  • Book/collection name

    Electrospun Nanofibers

  • ISBN

    978-0-08-100907-9

  • Number of pages of the result

    21

  • Pages from-to

    255-275

  • Number of pages of the book

    648

  • Publisher name

    Elsevier Sci. Ltd.

  • Place of publication

    Oxford

  • UT code for WoS chapter