Augustin Degomme

Computer Science · Physical Sciences

9h-index413citations23works0.02yr avg
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Research Topics

Parallel Computing and Optimization Techniques(12), Advanced Data Storage Technologies(9), Distributed and Parallel Computing Systems(7), Machine Learning in Materials Science(5), Advanced Chemical Physics Studies(4)

Publications23 total

<scp>MaX</scp> - Materials design at the exascale - a EuroHPC Centre of Excellence: Recent selected results
2025
MaX - Materials design at the exascale - a EuroHPC Centre of Excellence: Recent selected results
JuSER Publikationsportal·2025Open Access
How to verify the precision of density-functional-theory implementations via reproducible and universal workflows
Nature Reviews Physics·2023· 64 citedOpen Access
How to verify the precision of density-functional-theory implementations via reproducible and universal workflows
arXiv (Cornell University)·2023· 5 citedOpen Access
Density functional theory calculations of large systems: Interplay between fragments, observables, and computational complexity
Wiley Interdisciplinary Reviews Computational Molecular Science·2021· 36 cited
Common workflows for computing material properties using different quantum engines
npj Computational Materials·2021· 3 citedOpen Access
Flexibilities of wavelets as a computational basis set for large-scale electronic structure calculations
The Journal of Chemical Physics·2020· 108 citedOpen Access
Affordable and accurate large-scale hybrid-functional calculations on GPU-accelerated supercomputers
Journal of Physics Condensed Matter·2018· 28 citedOpen Access
Accurate, Large-Scale and Affordable Hybrid-PBE0 Calculations with GPU-Accelerated Supercomputers
arXiv (Cornell University)·2017Open Access
Predicting the Energy Consumption of MPI Applications at Scale Using a Single Node
HAL (Le Centre pour la Communication Scientifique Directe)·2017· 4 citedOpen Access
Predicting the Energy-Consumption of MPI Applications at Scale Using Only a Single Node
2017· 42 cited
Characterizing the Performance of Modern Architectures Through Opaque Benchmarks: Pitfalls Learned the Hard Way
HAL (Le Centre pour la Communication Scientifique Directe)·2017Open Access
Characterizing the Performance of Modern Architectures Through Opaque Benchmarks: Pitfalls Learned the Hard Way
2017· 7 cited
Simulating MPI Applications: The SMPI Approach
IEEE Transactions on Parallel and Distributed Systems·2017· 57 citedOpen Access
Predicting the Performance and the Power Consumption of MPI Applications With SimGrid
HAL (Le Centre pour la Communication Scientifique Directe)·2017· 5 citedOpen Access
Toward Better Simulation of MPI Applications on Ethernet/TCP Networks, chapter Performance Modeling and Simulation
SPIRE - Sciences Po Institutional REpository·2014
Toward Better Simulation of MPI Applications on Ethernet/TCP Networks
Lecture notes in computer science·2014· 26 cited
Toward Better Simulation of MPI Applications on Ethernet/TCP Networks
HAL (Le Centre pour la Communication Scientifique Directe)·2013Open Access
Improving Simulations of MPI Applications Using A Hybrid Network Model with Topology and Contention Support
HAL (Le Centre pour la Communication Scientifique Directe)·2013· 1 citedOpen Access
Performance Analysis of HPC Applications on Low-Power Embedded Platforms
Design, Automation &amp; Test in Europe Conference &amp; Exhibition (DATE), 2013·2013· 16 citedOpen Access
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Frequent Co-authors

Arnaud Legrand(12), Luigi Genovese(9), Brice Videau(8), Martin Quinson(8), George Markomanolis(5), Franz C. Heinrich(5), Alberto Garcı́a(4), Nicola Marzari(4), Gregor Michalicek(4), Daniel Wortmann(4), Mark Stillwell(4), Frédéric Suter(4), Paul Bédaride(4), Stéphane Genaud(4), Luka Stanisic(4), Laura E. Ratcliff(3), Stefan Goedecker(3), Emanuele Bosoni(3), Marnik Bercx(3), J. D. Broder(3)