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Enabling large language model agents for high-fidelity many-body perturbation theory calculations

Zhang, Benran et al.
arXiv (All) · Papers
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materials-science
Many-body perturbation theory (MBPT) methods, including the GW approximation, the GW plus Bethe-Salpeter equation (GW-BSE) method, and GW perturbation theory (GWPT), among others, provide accurate first-principles descriptions of excited-state properties and multiparticle interactions of materials.
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