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[HTML][HTML] From density response to energy functionals and back: An ab initio perspective on matter under extreme conditions
Energy functionals serve as the basis for different models and methods in quantum and
classical many-particle physics. Arguably, one of the most successful and widely used …
classical many-particle physics. Arguably, one of the most successful and widely used …
[HTML][HTML] Toward first principles-based simulations of dense hydrogen
Accurate knowledge of the properties of hydrogen at high compression is crucial for
astrophysics (eg, planetary and stellar interiors, brown dwarfs, atmosphere of compact stars) …
astrophysics (eg, planetary and stellar interiors, brown dwarfs, atmosphere of compact stars) …
[HTML][HTML] Electronic density response of warm dense matter
Matter at extreme temperatures and pressures—commonly known as warm dense matter
(WDM)—is ubiquitous throughout our Universe and occurs in astrophysical objects such as …
(WDM)—is ubiquitous throughout our Universe and occurs in astrophysical objects such as …
Electronic pair alignment and roton feature in the warm dense electron gas
The study of matter under extreme densities and temperatures as they occur, for example, in
astrophysical objects and nuclear fusion applications has emerged as one of the most active …
astrophysical objects and nuclear fusion applications has emerged as one of the most active …
[HTML][HTML] Ab initio path integral Monte Carlo simulations of warm dense two-component systems without fixed nodes: Structural properties
We present extensive new ab initio path integral Monte Carlo (PIMC) results for a variety of
structural properties of warm dense hydrogen and beryllium. To deal with the fermion sign …
structural properties of warm dense hydrogen and beryllium. To deal with the fermion sign …
Ab initio static exchange–correlation kernel across jacob's ladder without functional derivatives
The electronic exchange─ correlation (XC) kernel constitutes a fundamental input for the
estimation of a gamut of properties such as the dielectric characteristics, the thermal and …
estimation of a gamut of properties such as the dielectric characteristics, the thermal and …
Analysing the dynamic structure of warm dense matter in the imaginary-time domain: Theoretical models and simulations
Rigorous diagnostics of experiments with warm dense matter are notoriously difficult. A key
method is X-ray Thomson scattering (XRTS), but the interpretation of XRTS measurements is …
method is X-ray Thomson scattering (XRTS), but the interpretation of XRTS measurements is …
[HTML][HTML] Ab initio density response and local field factor of warm dense hydrogen
We present quasi-exact ab initio path integral Monte Carlo (PIMC) results for the partial static
density responses and local field factors of hydrogen in the warm dense matter regime, from …
density responses and local field factors of hydrogen in the warm dense matter regime, from …
X-ray Thomson scattering absolute intensity from the f-sum rule in the imaginary-time domain
We present a formally exact and simulation-free approach for the normalization of X-ray
Thomson scattering (XRTS) spectra based on the f-sum rule of the imaginary-time …
Thomson scattering (XRTS) spectra based on the f-sum rule of the imaginary-time …
[HTML][HTML] Fourier–Matsubara series expansion for imaginary–time correlation functions
A Fourier–Matsubara series expansion is derived for imaginary–time correlation functions
that constitutes the imaginary–time generalization of the infinite Matsubara series for equal …
that constitutes the imaginary–time generalization of the infinite Matsubara series for equal …