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Energy Oriented Center of Excellence : toward exascale for energy

Deliverables

Application mid-term outcome

Application mid-term outcome: progress in code optimization, performance evaluation results and directions for the second part of the project (Report, code DEM, PU)

Application starter outcome

Application starter outcome: preliminary performance evaluation results and first optimization roadmap

Preliminary results

Preliminary results and performance evaluation of LA solvers

Report on agreed dissemination strategy

The report describes the dissemination strategy which the partners intend to adopt and pursue in the project

First scientific results and progress on exascale tools

Progress report exascale application enabling and first scientific results achieved with new codes. Deliverable will include codes and demonstrators as well as written report.

First assessment report on dissemination, communication and networking

The report collects contributions from all tasks to describe the activities carried out in the first 18 months of the project

Intermediate report on I/O improvement for EoCoE codes

Intermediate report covering all I/O related improvements for EoCoE codes within the WP4 activities for the first 18 month and it provides a status update on all ongoing activties.

First ECG report

First report of the exascale co-design group

Scientific objectives and roadmap

Assessment of scientific objectives and roadmap for each flagship and satellite application

Publications

Quantum Monte Carlo determination of the principal Hugoniot of deuterium

Author(s): Michele Ruggeri, Markus Holzmann, David M. Ceperley, Carlo Pierleoni
Published in: Physical Review B, Issue 102/14, 2020, ISSN 2469-9950
DOI: 10.1103/physrevb.102.144108

Wall‐modeled large‐eddy simulation in a finite element framework

Author(s): Herbert Owen, Georgios Chrysokentis, Matias Avila, Daniel Mira, Guillaume Houzeaux, Ricard Borrell, Juan Carlos Cajas, Oriol Lehmkuhl
Published in: International Journal for Numerical Methods in Fluids, Issue 92/1, 2019, Page(s) 20-37, ISSN 0271-2091
DOI: 10.1002/fld.4770

AMG based on compatible weighted matching for GPUs

Author(s): Massimo Bernaschi, Pasqua D’Ambra, Dario Pasquini
Published in: Parallel Computing, Issue 92, 2020, Page(s) 102599, ISSN 0167-8191
DOI: 10.1016/j.parco.2019.102599

Linear collisionless dynamics of the GAM with kinetic electrons: Comparison simulations/theory

Author(s): V. Grandgirard, X. Garbet, Ch. Ehrlacher, A. Biancalani, A. Bottino, I. Novikau, Y. Asahi, E. Caschera, G. Dif-Pradalier, P. Donnel, Ph. Ghendrih, C. Gillot, G. Latu, Ch. Passeron, Y. Sarazin, D. Zarzoso
Published in: Physics of Plasmas, Issue 26/12, 2019, Page(s) 122304, ISSN 1070-664X
DOI: 10.1063/1.5113679

Execution data logs of a supercomputer workload over its extended lifetime

Author(s): Manuel Rodríguez-Pascual, Antonio J. Rubio-Montero, José A. Moríñigo, Rafael Mayo-García
Published in: Data in Brief, Issue 28, 2020, Page(s) 105006, ISSN 2352-3409
DOI: 10.1016/j.dib.2019.105006

Improving solve time of aggregation‐based adaptive AMG

Author(s): Pasqua D'Ambra, Panayot S. Vassilevski
Published in: Numerical Linear Algebra with Applications, Issue 26/6, 2019, ISSN 1070-5325
DOI: 10.1002/nla.2269

Fast electrostatic solvers for kinetic Monte Carlo simulations

Author(s): William Robert Saunders, James Grant, Eike Hermann Müller, Ian Thompson
Published in: Journal of Computational Physics, Issue 410, 2020, Page(s) 109379, ISSN 0021-9991
DOI: 10.1016/j.jcp.2020.109379

Parallel adaptive FETI‐DP using lightweight asynchronous dynamic load balancing

Author(s): Axel Klawonn, Martin J. Kühn, Oliver Rheinbach
Published in: International Journal for Numerical Methods in Engineering, Issue 121/4, 2019, Page(s) 621-643, ISSN 0029-5981
DOI: 10.1002/nme.6237

What is a deep defect? Combining Shockley-Read-Hall statistics with multiphonon recombination theory

Author(s): Basita Das, Irene Aguilera, Uwe Rau, Thomas Kirchartz
Published in: Physical Review Materials, Issue 4/2, 2020, ISSN 2475-9953
DOI: 10.1103/physrevmaterials.4.024602

A 3 km spatially and temporally consistent European daily soil moisture reanalysis from 2000 to 2015

Author(s): Bibi S. Naz, Stefan Kollet, Harrie-Jan Hendricks Franssen, Carsten Montzka, Wolfgang Kurtz
Published in: Scientific Data, Issue 7/1, 2020, ISSN 2052-4463
DOI: 10.1038/s41597-020-0450-6

SHEMAT-Suite: An open-source code for simulating flow, heat and species transport in porous media

Author(s): Johannes Keller, Volker Rath, Johanna Bruckmann, Darius Mottaghy, Christoph Clauser, Andreas Wolf, Ralf Seidler, H. Martin Bücker, Norbert Klitzsch
Published in: SoftwareX, Issue 12, 2020, Page(s) 100533, ISSN 2352-7110
DOI: 10.1016/j.softx.2020.100533

Software

MetalWalls 21.06

Author(s): Abel Marin-Laflèche; Matthieu Haefele; Laura Scalfi; Alessandro Coretti; Iurii Chubak; Thomas Dufils; Guillaume Jeanmairet; Stewart Reed; Alessandra Serva; Roxanne Berthin; Camille Bacon; Sara Bonella; Benjamin Rotenberg; Paul Madden; Mathieu Salanne
DOI: oai:zenodo.org:4912611; 10.5281/zenodo.4912611
Publisher: Zenodo