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By applying the particle-number projection to the finite-temperature BCS theory, the $S$-shaped heat capacity, which has recently been claimed to be a fingerprint of the superfluid-to-normal phase transition in nuclei, is reexamined. It is…

Nuclear Theory · Physics 2009-11-11 K. Esashika , H. Nakada , K. Tanabe

New energy-density functionals (EDFs) inspired by effective-field theories (EFTs) have been recently proposed. The present work focuses on three of such functionals which were developed to produce satisfactory equations of state for nuclear…

Nuclear Theory · Physics 2018-09-26 Jérémy Bonnard , Marcella Grasso , Denis Lacroix

In this work we give a comprehensive derivation of an exact and numerically feasible method to perform ab-initio calculations of quantum particles interacting with a quantized electromagnetic field. We present a hierachy of…

The notion of "paired" fermions is central to important condensed matter phenomena such as superconductivity and superfluidity. While the concept is widely used and its physical meaning is clear there exists no systematic and mathematical…

Quantum Physics · Physics 2009-11-13 Christina V. Kraus , Michael M. Wolf , J. Ignacio Cirac , Geza Giedke

Hydrogen bonding is an important non-covalent interaction that plays a major role in molecular self-organization and supramolecular structures. It can be described accurately with ab initio quantum chemical wave function methods, which…

Chemical Physics · Physics 2025-05-16 Usman Ahmed , Mikael P. Johansson , Susi Lehtola , Dage Sundholm

S-wave pairing in neutron matter is studied within an extension of correlated basis function (CBF) theory to include the strong, short range spatial correlations due to realistic nuclear forces and the pairing correlations of the Bardeen,…

Nuclear Theory · Physics 2008-11-26 Adelchi Fabrocini , Stefano Fantoni , Alexey Yu. Illarionov , Kevin E. Schmidt

The pairing gaps, heat capacities and level densities are calculated within the BCS-based quasiparticle approach including the effect of thermal fluctuations on the pairing field within the pairing model plus noncollective rotation along…

Nuclear Theory · Physics 2012-07-25 N. Quang Hung , N. Dinh Dang

In this work, the particle number projection at finite temperature is incorporated into self-consistent Skyrme density functional calculations. In particular, the energies of compound nuclei as a function of deformations are calculated…

Nuclear Theory · Physics 2026-03-02 Jiawei Chen , Yu Qiang , Junchen Pei

A recent mode coupling theory of higher-order correlation functions is tested on a simple hard-sphere fluid system at intermediate densities. Multi-point and multi-time correlation functions of the densities of conserved variables are…

Statistical Mechanics · Physics 2009-11-07 Ramses van Zon , Jeremy Schofield

The particle number projected BCS (PBCS) approximation is tested against the exact solution of the SO(5) Richardson-Gaudin model for isovector pairing in a system of non-degenerate single particle orbits. Two isovector PBCS wave functions…

Nuclear Theory · Physics 2009-11-05 N. Sandulescu , B. Errea , J. Dukelsky

The theoretical framework for higher-order correlation functions involving multiple times and multiple points in a classical, many-body system developed by Van Zon and Schofield [Phys. Rev. E 65, 011106 (2002)] is extended here to include…

Statistical Mechanics · Physics 2007-05-23 Ramses van Zon , Jeremy Schofield

We propose a description of nonequilibrium systems via a simple protocol that combines exchange-correlation potentials from density functional theory with self-energies of many-body perturbation theory. The approach, aimed to avoid double…

Strongly Correlated Electrons · Physics 2016-06-15 M. Hopjan , D. Karlsson , S. Ydman , C. Verdozzi , C. -O. Almbladh

The pairing Hamiltonian constitutes an important approximation in many- body systems, it is exactly soluble and quantum integrable. On the other hand, the continuum single particle level density (CSPLD) contains information about the…

Nuclear Theory · Physics 2012-04-13 R. Id Betan

Wavefunction structure is analyzed for dense interacting many-boson systems using Hamiltonian $H$, which is a sum of one-body $h(1)$ and an embedded GOE of $k$-body interaction $V(k)$ with strength $\lambda$. In the first analysis, a…

Statistical Mechanics · Physics 2021-04-07 Priyanka Rao , N. D. Chavda

A variational formulation for the calculation of interacting fermion systems based on the density-matrix functional theory is presented. Our formalism provides for a natural integration of explicit many-particle effects into standard…

Strongly Correlated Electrons · Physics 2013-05-29 Peter E. Bloechl , Christian F. J. Walther , Thomas Pruschke

We present a simple derivation of the stochastic equation obeyed by the density function for a system of Langevin processes interacting via a pairwise potential. The resulting equation is considerably different from the phenomenological…

Condensed Matter · Physics 2009-10-28 David S. Dean

We present an overview of the Hartree-Fock-Bogoliubov (HFB) theory of nucleonic superfluidity for finite nuclei. After introducing basic concepts related to pairing correlations, we show how the correlated pairs are incorporated into the…

Nuclear Theory · Physics 2017-08-23 J. Dobaczewski , W. Nazarewicz

The package "fhi96md" is an efficient code to perform density-functional theory total-energy calculations for materials ranging from insulators to transition metals. The package employs first-principles pseudopotentials, and a plane-wave…

Condensed Matter · Physics 2009-10-30 Michel Bockstedte , Alexander Kley , Joerg Neugebauer , Matthias Scheffler

Two basic correlation functions are calculated for a model of $N$ harmonically interacting identical particles in a parabolic potential well. The density and the pair correlation function of the model are investigated for the boson case.…

Statistical Mechanics · Physics 2009-10-30 F. Brosens , J. T. Devreese , L. F. Lemmens

Density functional theory is the workhorse of modern electronic structure calculations, with wide-ranging applications in chemistry, physics, materials science, and machine learning. At its heart lies the exchange-correlation functional, a…

Chemical Physics · Physics 2026-02-20 Fabien Tran , Susi Lehtola , Stefano Pittalis , Miguel A. L. Marques