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Search for "modelling" in Full Text gives 179 result(s) in Beilstein Journal of Nanotechnology.

Intermolecular vs molecule–substrate interactions: A combined STM and theoretical study of supramolecular phases on graphene/Ru(0001)

  • Michael Roos,
  • Benedikt Uhl,
  • Daniela Künzel,
  • Harry E. Hoster,
  • Axel Groß and
  • R. Jürgen Behm

Beilstein J. Nanotechnol. 2011, 2, 365–373, doi:10.3762/bjnano.2.42

Graphical Abstract
  • theoretical study [39]. These surfaces coordinates were then kept fixed in the subsequent relaxation of adsorbed PTCDA and BTP molecules. The interactions between molecule–graphene and molecule–Ru were treated as being additive. For the modelling of the molecule–graphene interactions, a single molecule was
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Published 12 Jul 2011

Superhydrophobicity in perfection: the outstanding properties of the lotus leaf

  • Hans J. Ensikat,
  • Petra Ditsche-Kuru,
  • Christoph Neinhuis and
  • Wilhelm Barthlott

Beilstein J. Nanotechnol. 2011, 2, 152–161, doi:10.3762/bjnano.2.19

Graphical Abstract
  • contact with water [20] and to prove the theories such as those of Wenzel or Cassie and Baxter. For precise modelling of the behaviour of natural water repellent surfaces, an exact knowledge of the chemical composition and molecular structure are essential. Resistance against environmental stress The
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Published 10 Mar 2011

Capillary origami: superhydrophobic ribbon surfaces and liquid marbles

  • Glen McHale,
  • Michael I. Newton,
  • Neil J. Shirtcliffe and
  • Nicasio R. Geraldi

Beilstein J. Nanotechnol. 2011, 2, 145–151, doi:10.3762/bjnano.2.18

Graphical Abstract
  • roughness factor rW and using the definition of the equilibrium contact angle on a rigid substrate of cosθe = (γSV − γSL)/γLV gives, Defining the Cassie–Baxter combination cosθCB = φscosθe − (1−φs), which is familiar from the modelling of droplets on superhydrophobic surfaces, gives, The similarity of
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Published 10 Mar 2011

The description of friction of silicon MEMS with surface roughness: virtues and limitations of a stochastic Prandtl–Tomlinson model and the simulation of vibration-induced friction reduction

  • W. Merlijn van Spengen,
  • Viviane Turq and
  • Joost W. M. Frenken

Beilstein J. Nanotechnol. 2010, 1, 163–171, doi:10.3762/bjnano.1.20

Graphical Abstract
  • systems (MEMS) devices with sliding surfaces. This new model is shown to exhibit the same features as previously reported experimental MEMS friction loop data. The correlation function of the surface roughness is shown to play a critical role in the modelling. It is experimentally obtained by probing the
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Published 22 Dec 2010
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