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ECP Podcast Interviews Argonne's Logan Ward About ExaLearn Progress

ECP Podcast Interviews Argonne's Logan Ward About ExaLearn Progress
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Novel Technique to Simulate Light-Matter Interactions at the Atomic Scale

Light–matter interactions form the basis of many important technologies, including lasers, light-emitting diodes (LEDs), and atomic clocks. However, usual computational approaches for modeling such interactions have limited usefulness and capability. Now, researchers from Japan have developed a technique that overcomes these limitations. ....

Kazuhiro Yabana , Laura Thomsonjan , International Journal Of High Performance Computing Applications , University Of Tsukuba , International Journal , High Performance Computing Applications , Professor Kazuhiro , Computational Science ,

Light-Matter Interactions Simulated on Fugaku Supercomputer

Researchers led by the University of Tsukuba present an improved way to model interactions between matter and light at the atomic scale TSUKUBA, Japan, ....

Kazuhiro Yabana , Quantum Leap Flagship Program , International Journal Of High Performance Computing Applications , University Of Tsukuba , International Journal , High Performance Computing Applications , Professor Kazuhiro , Computational Science , Postk Computer , Leap Flagship Program ,

ORNL Study on COVID-19 Earns Gordon Bell Prize Nomination

As the coronavirus pandemic entered its second year, a team of scientists from the U.S. Department of Energy’s Oak Ridge National Laboratory used the [.] ....

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Nanotechnology Now - Press Release: Open-source GPU technology for supercomputers: Researchers navigate advantages and disadvantages

Vladimir Stegailov, HSE University professor
CREDIT
Vladimir Stegailov
Abstract:
Researchers from the HSE International Laboratory for Supercomputer Atomistic Modelling and Multi-scale Analysis, JIHT RAS and MIPT have compared the performance of popular molecular modelling programs on GPU accelerators produced by AMD and Nvidia. In a paper published by the International Journal of High Performance Computing Applications, the scholars ported LAMMPS on the new open-source GPU technology, AMD HIP, for the first time.
Open-source GPU technology for supercomputers: Researchers navigate advantages and disadvantages
Moscow, Russia | Posted on April 30th, 2021
The scholars thoroughly analysed the performance of three molecular modelling programs - LAMMPS, Gromacs and OpenMM - on GPU accelerators Nvidia and AMD with comparable peak parameters. For the tests, they used the model of ApoA1 (Apolipoprotein A1) apolipoprotein in blood plasma, the main carrier pro ....

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