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20082026
most citedHeterogeneous Parallelization and Acceleration of Molecular Dynamics Simulations in GROMACS

966 citations

Showing 2015Show all

13 papers · 1 filter

cond-mat.str-el2015★ 116 cited

Standard model of the rare-earths, analyzed from the Hubbard I approximation

I. L. M. Locht, Y. O. Kvashnin, D. C. M. Rodrigues +10

In this work we examine critically the electronic structure of the rare-earth elements by use of the so-called Hubbard I approximation. From the theoretical side all measured featu…

physics.flu-dyn2015★ 81 cited

The effect of particle density in turbulent channel flow laden with finite size particles in semi-dilute conditions

Walter Fornari, Alberto Formenti, Francesco Picano +1

We study the effect of varying the mass and volume fraction of a suspension of rigid spheres dispersed in a turbulent channel flow. We performed several Direct Numerical Simulation…

math.NA2015★ 1 cited

Sobolev and Max Norm Error Estimates for Gaussian Beam Superpositions

Hailiang Liu, Olof Runborg, Nicolay M. Tanushev

This work is concerned with the accuracy of Gaussian beam superpositions, which are asymptotically valid high frequency solutions to linear hyperbolic partial differential equation…

cond-mat.mes-hall2015★ 334 cited

Resistive Graphene Humidity Sensors with Rapid and Direct Electrical Readout

Anderson David Smith, Karim Elgammal, Frank Niklaus +11

We demonstrate humidity sensing using a change of electrical resistance of a single- layer chemical vapor deposited (CVD) graphene that is placed on top of a SiO2 layer on a Si waf…

cond-mat.mtrl-sci2015★ 65 cited

Tunable damping, saturation magnetization, and exchange stiffness of half-Heusler NiMnSb thin films

Philipp Dürrenfeld, Felicitas Gerhard, Jonathan Chico +8

The half-metallic half-Heusler alloy NiMnSb is a promising candidate for applications in spintronic devices due to its low magnetic damping and its rich anisotropies. Here we use f…

physics.flu-dyn2015

Turbulence transition in the asymptotic suction boundary layer

Tobias Kreilos, Taras Khapko, Tobias M Schneider +5

We study the transition to turbulence in the asymptotic suction boundary layer (ASBL) by direct numerical simulation. Tracking the motion of trajectories intermediate between lamin…