1 citations · 1 across the 1 of their papers we have counts for
7 papers
Crossing the 12,000-atom barrier with heterogeneous quantum-classical supercomputing: quantum chemistry of protein-ligand complexes
Kenneth M. Merz, Akhil Shajan, Danil Kaliakin +20
Ab initio wavefunction methods provide accurate molecular simulations but their computational scaling restricts applications to small systems. We develop a workflow combining quant…
The Role of Quantum Computing in Advancing Scientific High-Performance Computing: A perspective from the ADAC Institute
Gilles Buchs, Thomas Beck, Ryan Bennink +19
Quantum computing (QC) has gained significant attention over the past two decades due to its potential for speeding up classically demanding tasks. This transition from an academic…
Quantum-HPC hybrid computation of biomolecular excited-state energies
Kentaro Yamamoto, Riku Masui, Takahito Nakajima +16
We develop a workflow within the ONIOM framework and demonstrate it on the hybrid computing system consisting of the supercomputer Fugaku and the Quantinuum Reimei trapped-ion quan…
Closed-loop calculations of electronic structure on a quantum processor and a classical supercomputer at full scale
Tomonori Shirakawa, Javier Robledo-Moreno, Toshinari Itoko +18
Quantum computers must operate in concert with classical computers to deliver on the promise of quantum advantage for practical problems. To achieve that, it is important to unders…
Asynchronous-Many-Task Systems: Challenges and Opportunities -- Scaling an AMR Astrophysics Code on Exascale machines using Kokkos and HPX
Gregor DaiÃ, Patrick Diehl, Jiakun Yan +9
Dynamic and adaptive mesh refinement is pivotal in high-resolution, multi-physics, multi-model simulations, necessitating precise physics resolution in localized areas across expan…
Quantum circuit synthesis via a random combinatorial search
Sahel Ashhab, Fumiki Yoshihara, Miwako Tsuji +2
We use a random search technique to find quantum gate sequences that implement perfect quantum state preparation or unitary operator synthesis with arbitrary targets. This approach…