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19922025
most citedEscaping free-energy minima

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physics.comp-ph2020★ 12 cited

Large scale simulation of pressure induced phase-field fracture propagation using Utopia

Patrick Zulian, Alena Kopaničáková, Maria Giuseppina Chiara Nestola +4

Non-linear phase field models are increasingly used for the simulation of fracture propagation models. The numerical simulation of fracture networks of realistic size requires the…

physics.comp-ph2019★ 4 cited

A comparative evaluation of three volume rendering libraries for the visualization of sheared thermal convection

Jean M. Favre, Alexander Blass

Oceans play a big role in the nature of our planet, about of our earth is covered by water. Strong currents are transporting warm water around the world making life possi…

physics.comp-ph2019★ 15 cited

Gyrokinetic Simulations on Many- and Multi-core Architectures with the Global Electromagnetic Particle-In-Cell Code ORB5

Noé Ohana, Claudio Gheller, Emmanuel Lanti +3

Gyrokinetic codes in plasma physics need outstanding computational resources to solve increasingly complex problems, requiring the effective exploitation of cutting-edge HPC archit…

physics.comp-ph2019★ 36 cited

DCA++: A software framework to solve correlated electron problems with modern quantum cluster methods

Urs R. Hähner, Gonzalo Alvarez, Thomas A. Maier +4

We present the first open release of the DCA++ project, a high-performance research software framework to solve quantum many-body problems with cutting edge quantum cluster algorit…

physics.comp-ph2018★ 1 cited

Towards a Mini-App for Smoothed Particle Hydrodynamics at Exascale

Danilo Guerrera, Rubén M. Cabezón, Jean-Guillaume Piccinali +5

The smoothed particle hydrodynamics (SPH) technique is a purely Lagrangian method, used in numerical simulations of fluids in astrophysics and computational fluid dynamics, among m…

physics.comp-ph2018★ 36 cited

Microhartree Precision in Density-Functional-Theory Calculations

Andris Gulans, Anton Kozhevnikov, Claudia Draxl

To address ultimate precision in density-functional-theory calculations we employ the full-potential linearized augmented planewave + local-orbital (LAPW+lo) method and justify its…