density functional theory 1electronic structure 1high-performance computing 1open-source software 1plane-wave methods 1pseudopotentials 1
From the 1 of 443 papers with an AI index.
29.3k citations
- Max Planck Institute for the Science of LightDE14 papers
- University of ArizonaUS14 papers
- Beijing Institute of TechnologyCN11 papers
- Complexity and Topology in Quantum MatterDE11 papers
- Ruhr University BochumDE11 papers
- TU Dortmund UniversityDE11 papers
- Leipzig UniversityDE10 papers
- University of WürzburgDE9 papers
- Centre National de la Recherche ScientifiqueFR8 papers
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Showing 2020 · cs.DCShow all
3 papers · 2 filters
cs.DC2020★ 3 cited
Usage Scenarios for Byte-Addressable Persistent Memory inHigh-Performance and Data Intensive Computing
Michele Weiland, Bernhard Homoelle
Byte-addressable persistent memory (B-APM) presents a new opportunity to bridge the performance gap between main memory and storage. In this paper, we present the usage scenarios f…
cs.DC2020
Efficient Ab-Initio Molecular Dynamic Simulations by Offloading Fast Fourier Transformations to FPGAs
Arjun Ramaswami, Tobias Kenter, Thomas D. Kühne +1
A large share of today's HPC workloads is used for Ab-Initio Molecular Dynamics (AIMD) simulations, where the interatomic forces are computed on-the-fly by means of accurate electr…
cs.DC2020★ 1 cited
Time- and Space-Optimal Clock Synchronization in the Beeping Model
Michael Feldmann, Ardalan Khazraei, Christian Scheideler
We consider the clock synchronization problem in the (discrete) beeping model: Given a network of nodes with each node having a clock value , the goa…