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Updated: Aug 16, 2025

Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
Published on: May 27, 2020
Dynamic Response of an Electron Gas: Towards the Exact Exchange-Correlation Kernel
James P F LeBlanc1, Kun Chen2, Kristjan Haule3
1Department of Physics and Physical Oceanography, Memorial University of Newfoundland, St. John's, Newfoundland & Labrador, Canada A1B 3X7.
Abstract:
Precise calculations of dynamics in the homogeneous electron gas (jellium model) are of fundamental importance for design and characterization of new materials. We introduce a diagrammatic Monte Carlo technique based on algorithmic Matsubara integration that allows us to compute frequency and momentum resolved finite temperature response directly in the real frequency domain using a series of connected Feynman diagrams. The data for charge response at moderate electron density are used to extract the frequency dependence of the exchange-correlation kernel at finite momenta and temperature. These results are as important for development of the time-dependent density functional theory for materials dynamics as ground state energies are for the density functional theory.
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