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20222024
most citedAccurate Deep Learning-aided Density-free Strategy for Many-Body Dispersion-corrected Density Functional Theory

25 citations · 52 across the 4 of their papers we have counts for

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Showing 2023 · physics.chem-phShow all

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physics.chem-ph2023★ 9 cited

Smooth Particle Mesh Ewald-integrated stochastic Lanczos Many-body Dispersion algorithm

Pier P. Poier, Louis Lagardère, Jean-Philip Piquemal

We derive and implement an alternative formulation of the Stochastic Lanczos algorithm to be employed in connection with the Many-Body Dispersion model (MBD). Indeed, this formulat…