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20162025
most citedTREXIO: A File Format and Library for Quantum Chemistry

29 citations · 30 across the 4 of their papers we have counts for

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physics.chem-ph2025

QMCkl: A Kernel Library for Quantum Monte Carlo Applications

Emiel Slootman, Vijay Gopal Chilkuri, Aurelien Delval +16

Quantum Monte Carlo (QMC) methods deliver highly accurate electronic structure calculations but are computationally intensive. The quantum Monte Carlo kernel library (QMCkl) provid…