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20132025
most citedTowards Universal Neural Network Potential for Material Discovery Applicable to Arbitrary Combination of 45 Elements

450 citations · 532 across the 9 of their papers we have counts for

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Showing 2016Show all

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physics.comp-ph2016★ 34 cited

Implementation of the multiconfiguration time-dependent Hatree-Fock method for general molecules on a multi-resolution Cartesian grid

Ryohto Sawada, Takeshi Sato, Kenichi L. Ishikawa

We report a three-dimensional numerical implementation of multiconfiguration time-dependent Hartree-Fock (MCTDHF) based on a multi-resolution Cartesian grid, with no need to assume…