25 citations · 42 across the 5 of their papers we have counts for
5 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 +21
We develop a workflow decomposing a molecule into fragments via quantum embedding and simulating them with a heterogeneous quantum-classical (HQC) method. We sample fragment electr…
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…
Efficient techniques to GPU Accelerations of Multi-Shot Quantum Computing Simulations
Jun Doi, Hiroshi Horii, Christopher Wood
Quantum computers are becoming practical for computing numerous applications. However, simulating quantum computing on classical computers is still demanding yet useful because cur…
Cache Blocking Technique to Large Scale Quantum Computing Simulation on Supercomputers
Jun Doi, Hiroshi Horii
Classical computers require large memory resources and computational power to simulate quantum circuits with a large number of qubits. Even supercomputers that can store huge amoun…
JLQCD IroIro++ lattice code on BG/Q
Guido Cossu, Jun Noaki, Shoji Hashimoto +4
We describe our experience on the multipurpose C++ code IroIro++ designed for JLQCD to run on the BG/Q installation at KEK. We discuss some details on the performance improvements…