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Center for Computational Quantum Physics

June 15, 2022

Ab initio Calculations in Atoms, Molecules, and Solids, Treating Spin-Orbit Coupling and Electron Interaction on Equal Footing
Center for Computational Quantum Physics

March 24, 2023

Accurate Kohn-Sham auxiliary system from the ground state density of solids
Center for Computational Quantum Physics

June 15, 2023

Bipolaronic superconductivity out of a Coulomb gas
Center for Computational Quantum Physics

June 15, 2023

Exchange-correlation effect in the charge response of a warm dense electron gas
Center for Computational Mathematics

March 11, 2024

Stabilizing the calculation of the self-energy in dynamical mean-field theory using constrained residual minimization
Center for Computational Quantum Physics

April 18, 2025

Training models using forces computed by stochastic electronic structure methods
Center for Computational Quantum Physics

April 18, 2025

Attractive Su-Schrieffer-Heeger-Hubbard model on a square lattice away from half-filling
Center for Computational Quantum Physics

April 18, 2025

Robustness of Trion State in Gated Monolayer MoSe2 under Pressure
Center for Computational Quantum Physics

August 13, 2025

An algorithm for computing perturbation series of dynamical mean field theory
Center for Computational Quantum Physics

August 13, 2025

Two-dimensional homogeneous electron gas with symmetric dual-gate screening: Exchange-correlation functional and other ground-state properties
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