Atomistic Simulation Center Inauguration Symposium, October 26-27, 2021 [SerienID : 2788]
The Atomistic Simulation Center (ASC) is a collaboration between the three National High Performance Computing (NHR) centers Paderborn (PC2), Erlangen (NHR@FAU), and Berlin (NHR@ZIB), providing their combined multifaceted expertise on atomistic simulations. The inauguration symposium celebrates the initiation of the ASC collaboration via a selected compilation of scientifically exciting talks from all areae of ASC-expertise. An overview of the symposium (including a list of invited speakers and a session schedule) can be found on our announcement flyer, which is available for download as PDF file (A3 landscape).
HPC
NHR
NHR@FAU
Atomistic Simulation
Scientific Computing
Semester
Wintersemester 2021/2022
Lehrenden
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aktualisiert
2021-12-23 15:41:00
Abonnements
0
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# 1Offener ZugangG. Wellein: Nationales Hochleistungsrechnen - NHR-AllianceProf. Dr. Gerhard Wellein2021-10-26 Wintersemester 2021/20221G. Wellein: Nationales Hochleistungsrechnen - NHR-AllianceProf. Dr. Gerhard Wellein2021-10-26 Wintersemester 2021/2022Offener Zugang
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# 2Offener ZugangP. Imhof: The Atomistic Simulation Center in Paderborn-Erlangen-BerlinProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/20222P. Imhof: The Atomistic Simulation Center in Paderborn-Erlangen-BerlinProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/2022Offener Zugang
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# 3Offener ZugangF. Höfling: GPU-powered molecular dynamics simulations of liquidsProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/20223F. Höfling: GPU-powered molecular dynamics simulations of liquidsProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/2022Offener Zugang
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# 4Offener ZugangT. Kühne: Very large scale simulations using the non-orthogonal local submatrix methodProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/20224T. Kühne: Very large scale simulations using the non-orthogonal local submatrix methodProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/2022Offener Zugang
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# 5Offener ZugangG. Schmidt: Understanding Phase Transitions in Quasi-1D SystemsProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/20225G. Schmidt: Understanding Phase Transitions in Quasi-1D SystemsProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/2022Offener Zugang
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# 6PasswortgeschütztR. Drautz: Atomic cluster expansion for bridging from electrons to materials propertiesProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/20226R. Drautz: Atomic cluster expansion for bridging from electrons to materials propertiesProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/2022PasswortgeschütztGesperrt clip
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# 7PasswortgeschütztH. Gohlke: Structure-based computational enzyme engineeringProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/20227H. Gohlke: Structure-based computational enzyme engineeringProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/2022PasswortgeschütztGesperrt clip
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# 8PasswortgeschütztA. Görling: Chemical accuracy with σ-functionals for the Kohn-Sham correlation energyProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/20228A. Görling: Chemical accuracy with σ-functionals for the Kohn-Sham correlation energyProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/2022PasswortgeschütztGesperrt clip
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# 9PasswortgeschütztB. Keller: Molecules move! Disentangling complex molecular dynamics and their functionProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/20229B. Keller: Molecules move! Disentangling complex molecular dynamics and their functionProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/2022PasswortgeschütztGesperrt clip
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# 10PasswortgeschütztU. Kleinekathöfer: Transport in biomolecular systems: On light harvesting and nanoporesProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/202210U. Kleinekathöfer: Transport in biomolecular systems: On light harvesting and nanoporesProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/2022PasswortgeschütztGesperrt clip
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# 11PasswortgeschütztCh. Ochsenfeld: Linear-scaling methods for solving the Schrödinger equation of complex systemsProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/202211Ch. Ochsenfeld: Linear-scaling methods for solving the Schrödinger equation of complex systemsProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/2022PasswortgeschütztGesperrt clip
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# 12PasswortgeschütztCh. Plessl: Towards Exascale Computing for Atomistic Simulations with GPUsProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/202212Ch. Plessl: Towards Exascale Computing for Atomistic Simulations with GPUsProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/2022PasswortgeschütztGesperrt clip
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# 13PasswortgeschütztP. Saalfrank: Photochemistry and Spectroscopy of Molecules at Surfaces: Insights from Ab Initio Molecular DynamicsProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/202213P. Saalfrank: Photochemistry and Spectroscopy of Molecules at Surfaces: Insights from Ab Initio Molecular DynamicsProf. Dr. Petra Imhof2021-10-27 Wintersemester 2021/2022PasswortgeschütztGesperrt clip
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# 14PasswortgeschütztA. Smith: Multiscale modeling of SILP catalysisProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/202214A. Smith: Multiscale modeling of SILP catalysisProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/2022PasswortgeschütztGesperrt clip
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# 15PasswortgeschütztF. Gräter: Towards reactive Molecular Dynamics simulations: learning barriersProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/202215F. Gräter: Towards reactive Molecular Dynamics simulations: learning barriersProf. Dr. Petra Imhof2021-10-26 Wintersemester 2021/2022PasswortgeschütztGesperrt clip
