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19932026
most citedAdvanced capabilities for materials modelling with Quantum ESPRESSO

7.7k citations

Showing 2012Show all

83 papers · 1 filter

cond-mat.soft2012★ 13 cited

Simple flexible polymers in a spherical cage

M. Marenz, J. Zierenberg, H. Arkin +1

We report the results of Monte Carlo simulations investigating the effect of a spherical confinement within a simple model for a flexible homopolymer. We use the parallel tempering…

hep-ph2012★ 26 cited

Many-flavor Phase Diagram of the (2+1)d Gross-Neveu Model at Finite Temperature

Daniel D. Scherer, Jens Braun, Holger Gies

We study the phase diagram of the Gross-Neveu model in d=2+1 space-time dimensions in the plane spanned by temperature and the number of massless fermion flavors. We use a function…

cond-mat.stat-mech2012★ 62 cited

Scaling Properties of a Parallel Implementation of the Multicanonical Algorithm

Johannes Zierenberg, Martin Marenz, Wolfhard Janke

The multicanonical method has been proven powerful for statistical investigations of lattice and off-lattice systems throughout the last two decades. We discuss an intuitive but ve…

cond-mat.stat-mech2012★ 5 cited

Application of Simulated Tempering and Magnetizing to a Two-Dimensional Potts Model

Tetsuro Nagai, Yuko Okamoto, Wolfhard Janke

We applied the simulated tempering and magnetizing (STM) method to the two-dimensional three-state Potts model in an external magnetic field in order to perform further investigati…

physics.soc-ph2012★ 5 cited

Axelrod's Model with Surface Tension

Bruno Pace, Carmen P. C. Prado

In this work we propose a subtle change in Axelrod's model for the dissemination of culture. The mechanism consists of excluding non-interacting neighbours from the set of neighbou…

cond-mat.supr-con2012

As NMR study of overdoped CeFeAsOF

Damian Rybicki, Thomas Meissner, Grant V. M. Williams +3

We report the results from a As NMR study on the overdoped iron pnictide superconductor, CeFeAsOF. Two peaks are observed in the NMR spectra for temperatures…