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Tristan B. Guest and Alex E. Hay
On mixed sand?gravel beaches, impacts from gravel- and cobble-sized grains?mobilized by the energetic shorebreak?limit the utility of in situ instrumentation for measuring the small-scale response of the beach face on wave period time scales. We present ...
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Silke A. J. Tas, Dirk S. van Maren and Ad J. H. M. Reniers
Cheniers are important for stabilising mud-dominated coastlines. A chenier is a body of wave-reworked, coarse-grained sediment consisting of sand and shells overlying a muddy substrate. In this paper we present and analyse a week of field observations of...
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Son Ich Ngo and Young-Il Lim
This review covers the scope of multiscale computational fluid dynamics (CFD), laying the framework for studying hydrodynamics with and without chemical reactions in single and multiple phases regarded as continuum fluids. The molecular, coarse-grained p...
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Igor A. Ostanin
Pág. 102 - 111
A universal framework for modeling composites and fabrics of micro- and nanofibers, such as carbon nanotubes, carbon fibers and amyloid fibrils, is presented. Within this framework, fibers are represented with chains of rigid bodies, linked with elastic ...
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Philipp S. Orekhov,Ilya V. Kirillov,Vladimir A. Fedorov,Ilya B. Kovalenko,Nikita B. Gudimchuk,Artem A. Zhmurov
Pág. 19 - 22
Even when modern computational platforms and parallel techniques are used, conventional all-atom simulations are limited both in terms of reachable timescale and number of atoms in the biomolecular system of interest. On the other hand, coarse-grained mo...
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Joseph F. Rudzinski and Tristan Bereau
Coarse-grained molecular simulation models can provide significant insight into the complex behavior of protein systems, but suffer from an inherently distorted description of dynamical properties. We recently demonstrated that, for a heptapeptide of ala...
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Neil A. Mehta and Deborah A. Levin
In this work, the use of molecular dynamics as a predictive tool for modeling the atomistic behavior of electrospray propulsion is discussed. 1-ethyl-3-methylimidazolium tetrafluoroborate (EMIM-BF4" role="presentation" style="position: relative;">44
4
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B. Shadrack Jabes and Christian Krekeler
We use the Grand Canonical Adaptive Resolution Molecular Dynamics Technique (GC-AdResS) to examine the essential degrees of freedom necessary for reproducing the structural properties of the imidazolium class of ionic liquids. In this technique, the atom...
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Rashid Bashir and Eric Pastora Chevez
Oilfield-produced brine is a major source of salt contamination in soil and groundwater. Salt transport in the upper soil layers is controlled by the atmospheric interactions via infiltration of meteoritic water. In lower layers, it is controlled by fluc...
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Gleb Kraev, Ernst-Detlef Schulze, Alla Yurova, Alexander Kholodov, Evgeny Chuvilin and Elizaveta Rivkina
Evidences of highly localized methane fluxes are reported from the Arctic shelf, hot spots of methane emissions in thermokarst lakes, and are believed to evolve to features like Yamal crater on land. The origin of large methane outbursts is problematic. ...
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