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  4. StochasticGW-GPU: Rapid Quasi-Particle Energies for Molecules beyond 10,000 Atoms

StochasticGW-GPU: Rapid Quasi-Particle Energies for Molecules beyond 10,000 Atoms

2026-04-07 | StochasticGW-GPU: Rapid Quasi-Particle Energies for Molecules beyond 10,000 Atoms – J. Chem. Theory Comput. Phillip S. Thomas, Minh Nguyen, Dimitri Bazile, Tucker Allen, Barry Y. Li, Wenfei Li, Mauro Del Ben, Jack Deslippe, Daniel Neuhauser*.

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