most citedCrossing the 12,000-atom barrier with heterogeneous quantum-classical supercomputing: quantum chemistry of protein-ligand complexes

1 citations · 1 across the 3 of their papers we have counts for

collaborators

8 papers

math.AP2026

Diffusion stabilises time-periodic solutions in conservation laws coupled to a relaxation oscillator

Julien Barré, Nils Berglund, Hiroshi Horii

We study a viscous one-dimensional conservation law, coupled to a fast ordinary differential equation. For a vanishing viscosity, the system has an infinite-dimensional family of t…

cs.ET2026

Examining QRMI as a Unified Interface for Quantum-HPC Integration

Thomas Badts, Tim Boyle, Claudio Carvalho +27

The efficient and scalable integration of quantum resources into high-performance computing (HPC) environments requires standardized mechanisms for resource management, scheduling,…

quant-ph20261 cited

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…

cs.ET2026

Reference Architecture of a Quantum-Centric Supercomputer

Seetharami Seelam, Jerry M. Chow, Antonio Córcoles +10

Quantum computers have demonstrated utility in simulating quantum systems beyond brute-force classical approaches. As the community builds on these demonstrations to explore using…

cs.DC2026

GPU-Accelerated Selected Basis Diagonalization with Thrust for SQD-based Algorithms

Jun Doi, Tomonori Shirakawa, Yukio Kawashima +2

Selected Basis Diagonalization (SBD) plays a central role in Sample-based Quantum Diagonalization (SQD), where iterative diagonalization of the Hamiltonian in selected configuratio…

quant-ph2025

Observability Architecture for Quantum-Centric Supercomputing Workflows

Naoki Kanazawa, Yuto Morohoshi, Hitomi Takahashi +3

Quantum-centric supercomputing (QCSC) workflows often involve hybrid classical-quantum algorithms that are inherently probabilistic and executed on remote quantum hardware, making…