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20132026
most citedCP2K: An Electronic Structure and Molecular Dynamics Software Package -- Quickstep: Efficient and Accurate Electronic Structure Calculations

4.5k citations · 4.6k across the 32 of their papers we have counts for

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cond-mat.soft2018★ 9 cited

Quantum Monte Carlo calculations of van der Waals interactions between aromatic benzene rings

S. Azadi, T. D. Kühne

The magnitude of finite-size effects and Coulomb interactions in quantum Monte Carlo simulations of van der Waals interactions between weakly bonded benzene molecules are investiga…