On the Path towards Exascale Computing in the Czech Republic and in Europe

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1 MARTIN PALKOVIČ Martin Palkovič is the managing director of IT4Innovations, the national supercomputing center in the Czech Republic. Before joining IT4Innovations, he was working for 12 years at imec Leuven, Belgium. At imec, Dr. Palkovič among other things participated in implementing innovative solutions for information and communication technologies for large multinational companies (e.g. Samsung, Panasonic) and led the technology transfer of imec MPSoC technology to Toshiba. He is author and co-author of more than 50 publications in the embedded system domain. Dr. Palkovič is member of "Future and Emerging Technologies" Advisory Group of H2020 and Council for Large Infrastructures for Research, Experimental Development and Innovation of the Czech Republic. On the Path towards Exascale Computing in the Czech Republic and in Europe

2 On the path towards exascale computing in the Czech Republic and in Europe Martin Palkovič Exascale Computing Workshop Salt Lake City,

3 The Czech Republic is famous for: [source:wikipedia]

4 Outline HPC in the Czech Republic HPC infrastructure HPC in the Czech Republic exascale projects Path to exascale at EU level

5 IT4Innovations national supercomputing center of the Czech Republic (IT4I) Prague Ostrava Brno Mission of IT4Innovations: Our mission is to deliver scientifically excellent and industry relevant research in the field of high performance computing. We are providing state-of-the-art technology and expertise in high performance computing and make it available for Czech and international research teams from academia and industry.

6 IT4Innovations operates most powerful supercomputers in the Czech Republic July 2013 Sept 2015 Rmax 0.08 PFLOPS 209x16x24x365= ~30 mil corehours/year Rmax 1.46 PFLOPS 1008x24x24x365= ~200 mil corehours/year

7 IT4I has unique infrastructure to cool and power supercomputers

8 IT4I is the only HPC large research infrastructure in the Czech Republic

9 IT4Innovations is member of PRACE, ETP4HPC and is the IPCC Parallel Computing Center at IT4Innovations

10 We were local organizer of HiPEAC, IXPUG and PRACE days in 2016

11 Outline HPC in the Czech Republic HPC infrastructure HPC in the Czech Republic exascale projects Path to exascale at EU level

12 ESPRESO library for exascale based on FEM/BEM domain decomposition Preprocessing ESPRESO C++ library Mesh Processing Postprocessing Visualization ESPRESO Generator ESPRESO API CP U Matrix Assembler FEM/BEM (BEM4I) TFETI/Hybrid TFETI Solvers MIC GPU EnSight / Visit Paraview Catalyst

13 Solver Time [s] ESPRESO successfully tested on largest machine in CR, EU and US Engineering problems rd in TOP500 LIST Weak scalability test (3D heat transfer) FETI Preprocessing Problem size [billion DOF] Number of compute nodes [-]

14 Processing time [s] IPCC at IT4Innovations implements ESPRESO on Xeon Phi million DOF, Hybrid FETI, CG Solver Runtime Heat Transfer CG Solver Runtime w. Lumped Precon CPU - PARDISO - Lumped prec 7.8x MIC - SC - Lumped prec stopping criteria: 1e-4 subdomain size: 4096 DOF cluster size: 2197subdomains cluster size: 7.5 million DOF Number of compute nodes [-] IT4Innovations Salomon Supercomputer

15 IT4Innovations is active in algorithms and programming tools at EU level NEXTGenIO ExaNEST ECOSCALE ExaNoDe Mont-Blanc 3 EXTRA SAGE ExaHYPE HPC Ecosystem EXDCI Eurolab-4- HPC Centres of Excellence Project Start: Autumn 2015 [source: European Commission] NLAFET ExaFLOW ExCAPE ComPat READEX ESCAPE ALLScale INTERTWINE ANTAREX Mango GreenFLASH BioExcel COEGSS EoCoE E-CAM ESiWACE MAX NOMAD PoP

16 Energy optimization for exascale using autotuning in the READEX Overall PERMON FETI CG solver default setting, best static, best dynamic Fine-grain energy savings

17 Dynamism in the navigation use case in ANTAREX HPC

18 Exascale machine learning for problems in pharmaceutical industry in ExCAPE Problem: How to predict compound activity for developing new drugs? High Performance Computing Chemogenomic, modeling the interaction of the chemical compounds with the biological organism Chemogenomics Machine learning

19 Outline HPC in the Czech Republic HPC infrastructure HPC in the Czech Republic exascale projects Path to exascale at EU level

20 EU HPC strategy combines three elements Access to HPC resources Exascale systems PRACE HPC applications FETHPC cppp ETP4HPC SRA Centres of Exc. complemented with training, education, skills development in HPC [source: European Commission]

21 HPC ecosystem development (starting Sept. 2015) l l l l l l l l l l Projects from 2014 Call: Technology building blocks & 1 st round CoEs Projects start Projects from 2016 Call: 1 st level co-design Projects from 2017 Call: Exascale transition [source: European Commission] Future 2018/19/20 Calls: Extreme Scale Demonstrators (2 nd -level co-design / integration) Exascale transition 2 nd round of CoEs

22 EU low power processor technologies (for high-performance computing) FET-HPC (Exascale computing) ICT-06 (Cloud computing) ICT-05 (Customised and low energy computing) Low power processor technologies: Proposals will provide innovative processor designs delivering a substantial and measurable improvement over the current state of the art in energy/performance ratio for typical high performance computing and server workloads. The limitations of today's technologies will be addressed, ICT-01 (Smart CPS) [source: European Commission]

23 European open science cloud (EOSC) and European data infrastructure (EDI) ESFRIs, RIs and scientific clouds European Open Science Cloud e-infrastructures European Data Infrastructure [source: European Commission] Note: oversimplification

24 Conclusions IT4Innovations is the national supercomputing center of the Czech Republic with modern infrastructure serving academic and industrial users with strong link to other national supercomputing centers and EU HPC landscape IT4Innovations looks in the exascale projects at scalability challenge of massively parallel sparse linear solvers and power challenge (utilization of autotuning) as well as new topics as machine learning for pharma industry EU does not want to lag behind in the way to exascale and invests 700 mil. EUR to HPC in years within H2020

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