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The hyperfine interaction constants of the 2p4(3P)3p 2Do_{3/2,5/2}, 4Do_{1/2-7/2} and 4Po_{1/2-5/2} levels in neutral fluorine are investigated theoretically. Large-scale calculations are carried out using the multiconfiguration…

Atomic Physics · Physics 2015-06-16 Thomas Carette , Messaoud Nemouchi , Jiguang Li , Michel Godefroid

The standard model of classical Density Functional Theory for pair potentials consists of a hard-sphere functional plus a mean-field term accounting for long ranged attraction. However, most implementations using sophisticated Fundamental…

Computational Physics · Physics 2021-01-04 James F. Lutsko , Cédric Schoonen

We showcase the advantages of orbital-free density-potential functional theory (DPFT), a more flexible variant of Hohenberg-Kohn density functional theory. DPFT resolves the usual trouble with the gradient-expanded kinetic energy functional…

Quantum Gases · Physics 2021-06-16 Martin-Isbjörn Trappe , Jun Hao Hue , Berthold-Georg Englert

Collective nuclear excitations, like giant resonances, are sensitive to nuclear deformation, as evidenced by alterations in their excitation energies and transition strength distributions. A common theoretical framework to study these…

Nuclear Theory · Physics 2024-04-23 A. Ravlić , T. Nikšić , Y. F. Niu , P. Ring , N. Paar

Relativistic energy density functionals (REDF) provide a complete and accurate, global description of nuclear structure phenomena. A modern semi-empirical functional, adjusted to the nuclear matter equation of state and to empirical masses…

Nuclear Theory · Physics 2015-06-05 V. Prassa , T. Niksic , G. A. Lalazissis , D. Vretenar

Fractional cumulative residual entropy (FCRE) is a powerful tool for the analysis of complex systems. Most of the theoretical results and applications related to the FCRE of the lifetime random variable are based on the distribution…

Statistics Theory · Mathematics 2025-02-04 Iona Ann Sebastian , S. M. Sunoj

Within a multi-channel formulation of $\pi\pi$ scattering, we investigate the use of the finite-volume Hamiltonian approach to resolve scattering observables from lattice QCD spectra. The asymptotic matching of the well-known L\"uscher…

High Energy Physics - Lattice · Physics 2014-11-21 Jia-Jun Wu , T. -S. H. Lee , A. W. Thomas , R. D. Young

We survey approaches to nonrelativistic density functional theory (DFT) for nuclei using progress toward ab initio DFT for Coulomb systems as a guide. Ab initio DFT starts with a microscopic Hamiltonian and is naturally formulated using…

Nuclear Theory · Physics 2009-12-04 J. E. Drut , R. J. Furnstahl , L. Platter

Studies of fission dynamics, based on nuclear energy density functionals, have shown that the coupling between shape and pairing degrees of freedom has a pronounced effect on the nonperturbative collective inertia and, therefore, on dynamic…

Nuclear Theory · Physics 2016-05-24 Jie Zhao , Bing-Nan Lu , Tamara Niksic , Dario Vretenar , Shan-Gui Zhou

Collective inertial mass coefficients with respect to translational, relative, and rotational motions are microscopically calculated, along the collective reaction path self-consistently determined, based on the adiabatic self-consistent…

Nuclear Theory · Physics 2022-03-14 Kai Wen , Takashi Nakatsukasa

Large scale Density Functional Theory (DFT) based electronic structure calculations are highly time consuming and scale poorly with system size. While semi-empirical approximations to DFT result in a reduction in computational time versus…

Materials Science · Physics 2016-12-21 Ganesh Hegde , R. Chris Bowen

The collective structure of atomic nuclei intermediate between spherical and quadrupole deformed structure presents challenges to theoretical understanding. However, models have recently been proposed in terms of potentials which are soft…

Nuclear Experiment · Physics 2020-01-07 M. A. Caprio

We present a new method to resum the effect of large scale motions in the Effective Field Theory of Large Scale Structures. Because the linear power spectrum in $\Lambda$CDM is not scale free the effects of the large scale flows are…

Cosmology and Nongalactic Astrophysics · Physics 2015-06-19 Leonardo Senatore , Matias Zaldarriaga

We propose a systematic method to block-diagonalize the finite volume effective Hamiltonian for two-particle systems with arbitrary spin in both the rest and moving frame. The framework is convenient and efficient for addressing the…

High Energy Physics - Lattice · Physics 2025-12-19 Kang Yu , Guang-Juan Wang , Jia-Jun Wu , Zhi Yang

Ab initio modeling of dynamic structure factors (DSF) and related density response properties in the warm dense matter (WDM) regime is a challenging computational task. The DSF, convolved with a probing X-ray beam and instrument function,…

Multi-configurational wave functions are known to describe electronic structure across a Born-Oppenheimer surface qualitatively correct. However, for quantitative reaction energies, dynamical correlation originating from the many…

Chemical Physics · Physics 2020-04-16 Christopher J. Stein , Markus Reiher

Many chemical systems cannot be described by quantum chemistry methods based on a singlereference wave function. Accurate predictions of energetic and spectroscopic properties require a delicate balance between describing the most important…

Chemical Physics · Physics 2018-06-12 Erik Donovan Hedegård , Julien Toulouse , Hans Jørgen Aagaard Jensen

Deterministic models for radiation transport describe the density of radiation particles moving through a background material. In radiation therapy applications, the phase space of this density is composed of energy, spatial position and…

Numerical Analysis · Mathematics 2021-11-16 Jonas Kusch , Pia Stammer

A method for beyond-mean-field calculations based on an energy density functional is described. The main idea is to map the energy surface for the nuclear quadrupole deformation, obtained from an energy density functional at the mean-field…

Nuclear Theory · Physics 2022-12-16 J. Ljungberg , J. Boström , B. G. Carlsson , A. Idini , J. Rotureau

Stochastic and mixed stochastic-deterministic density functional theory (DFT) are promising new approaches for the calculation of the equation-of-state and transport properties in materials under extreme conditions. In the intermediate warm…

Computational Physics · Physics 2023-09-27 Vidushi Sharma , Lee A. Collins , Alexander J. White
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