78 citations · 78 across the 3 of their papers we have counts for
3 papers
stat.AP2026
Analysis of molecular dynamics simulation data via statistical distances between covariance matrices
Yusuke Ono, Takumi Sato, Kenji Yasuoka +1
Molecular dynamics (MD) simulations are powerful tools for elucidating the macroscopic physical properties of materials from microscopic atomic behaviors. However, the massive, hig…
quant-ph2024
A Study on Quantum Car-Parrinello Molecular Dynamics with Classical Shadows for Resource Efficient Molecular Simulation
Honomi Kashihara, Yudai Suzuki, Kenji Yasuoka
Ab-initio molecular dynamics (AIMD) is a powerful tool to simulate physical movements of molecules for investigating properties of materials. While AIMD is successful in some appli…
math.NA2011★ 78 cited
Petascale turbulence simulation using a highly parallel fast multipole method on GPUs
R. Yokota, L. A. Barba, T. Narumi +1
This paper reports large-scale direct numerical simulations of homogeneous-isotropic fluid turbulence, achieving sustained performance of 1.08 petaflop/s on gpu hardware using sing…