Articles with "atomistic scale" as a keyword



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Atomistic Scale Effects of Lipopolysaccharide Modifications on Bacterial Outer Membrane Defenses.

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Published in 2018 at "Biophysical journal"

DOI: 10.1016/j.bpj.2018.02.006

Abstract: Lipopolysaccharides (LPS) are a main constituent of the outer membrane of Gram-negative bacteria. Salmonella enterica, like many other bacterial species, are able to chemically modify the structure of their LPS molecules through the PhoPQ pathway… read more here.

Keywords: bacterial outer; scale effects; atomistic scale; outer membrane ... See more keywords
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Multi-scale dynamic failure analysis of 3D laminated composites using BEM and MCZM

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Published in 2019 at "Engineering Analysis with Boundary Elements"

DOI: 10.1016/j.enganabound.2019.03.017

Abstract: Abstract This paper presents a multi-scale approach to analyze failure in laminated composites. First, at the continuum mesoscale, the boundary element method (BEM) is used with the anisotropic 3D fundamental solution based on double Fourier… read more here.

Keywords: bem; multi scale; failure; laminated composites ... See more keywords
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Step bunching and macrostep formation in 1D atomistic scale model of unstable vicinal crystal growth

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Published in 2017 at "Journal of Crystal Growth"

DOI: 10.1016/j.jcrysgro.2016.11.121

Abstract: Abstract We devise a new 1D atomistic scale model of vicinal growth based on Cellular Automaton. In it the step motion is realized by executing the automaton rule prescribing how adatoms incorporate into the vicinal… read more here.

Keywords: step; time; atomistic scale; scale model ... See more keywords
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Atomistic-scale insights into the crosslinking of polyethylene induced by peroxides

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Published in 2019 at "Polymer"

DOI: 10.1016/j.polymer.2019.121901

Abstract: Abstract Dicumyl peroxide (DCP) is the most commonly used peroxide crosslinking agent for polyethylene (PE) in high voltage power cables. The DCP reactions in the PE matrix lead to the formation of a range of… read more here.

Keywords: scale insights; atomistic scale; insights crosslinking; polyethylene ... See more keywords