activity
20242026
most citedCrossing the 12,000-atom barrier with heterogeneous quantum-classical supercomputing: quantum chemistry of protein-ligand complexes

1 citations · 2 across the 4 of their papers we have counts for

collaborators

6 papers

cs.DC2026

TRANSIT: Transparent Scale-in for Multi-Node LLM Training

Hyungyo Kim, Nicholas Satchanov, Hrishi Shah +9

TRANSIT is a transparent scale-in framework to enable multi-node model training on fewer GPUs while maintaining training efficiency by transparently leveraging CPU DRAM as an exten…

quant-ph2026

Quantum Computations on Fusion Blanket Molten Salts

Susanta Das, Thiago J. Pinheiro Dos Santos, Subhamoy Bhowmik +14

Molten salts such as FLiBe (2LiF--BeF) are leading blanket materials for breeding and recovering tritium in fusion reactors. Predicting tritium speciation requires accurate ele…

quant-ph2026★ 1 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 +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…

cs.ET2026

Scaling Sample-Based Quantum Diagonalization on GPU-Accelerated Systems using OpenMP Offload

Robert Walkup, Juha Jäykkä, Igor Pasichnyk +14

Hybrid quantum-HPC algorithms advance research by delegating complex tasks to quantum processors and using HPC systems to orchestrate workflows and complementary computations. Samp…

quant-ph2025

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…

cs.DC2024★ 1 cited

The infrastructure powering IBM's Gen AI model development

Talia Gershon, Seetharami Seelam, Brian Belgodere +143

AI Infrastructure plays a key role in the speed and cost-competitiveness of developing and deploying advanced AI models. The current demand for powerful AI infrastructure for model…