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Energies and spectra of solids from the algorithmic inversion of dynamical Hubbard functionals

Tommaso Chiarotti1,*, Andrea Ferretti2, and Nicola Marzari1,3

  • *Contact author: tommaso.chiarotti@epfl.ch

Electronic structure and dynamical correlations in antiferromagnetic BiFeO3

Yihan Wu, Mario Caserta, Tommaso Chiarotti, and Nicola Marzari

Phys. Rev. Research 8 033375 (2026)

Dynamical Hubbard approach to correlated materials: The case of transition-metal monoxides

Mario Caserta, Tommaso Chiarotti, Marco Vanzini, and Nicola Marzari

Phys. Rev. Research 8 L032026 (2026)

Benchmarking the Plasmon-Pole and Multipole Approximations in the Yambo Code Using the GW100 Data Set

M. Bonacci, D. A. Leon, N. Spallanzani, E. Molinari, D. Varsano, A. Ferretti, and C. Cardoso

J. Chem. Theory Comput. 22 6718 (2026)

Trimeron ordering, bandgap, and polaron hopping in magnetite

Nikita Fominykh and Vladimir Stegailov

Phys. Rev. B 111 115130 (2025)

Broken symmetry solutions in one-dimensional lattice models via many-body perturbation theory

Matteo Quinzi, Tommaso Chiarotti, Marco Gibertini, and Andrea Ferretti

Phys. Rev. B 111 125148 (2025)

Spectral properties from an efficient analytical representation of the GW self-energy within a multipole approximation

Dario A. Leon, Kristian Berland, and Claudia Cardoso

Phys. Rev. B 111 195147 (2025)

Potential energy surfaces from many-body functionals: Analytical benchmarks and conserving many-body approximations

Giovanna Lani and Nicola Marzari

Phys. Rev. Research 6 043304 (2024)

Green's function embedding using sum-over-pole representations

Andrea Ferretti, Tommaso Chiarotti, and Nicola Marzari

Phys. Rev. B 110 045149 (2024)

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