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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

A nonlinear master equation is derived, reflecting properly the entropy of open quantum systems. In contrast to linear alternatives, its equilibrium solution is exactly the canonical Gibbs density matrix. The corresponding nonlinear…

Quantum Physics · Physics 2021-02-08 Roumen Tsekov

We suggest to include the density of electron charge explicitly in the electron potential of density functional theory, rather than implicitly via exchange-correlation functionals. The advantages of the approach are conceptual and…

Materials Science · Physics 2007-05-23 Werner A. Hofer , Krisztian Palotas

Relativistic quantum dynamics requires a unitary representation of the Poincare group on the Hilbert space of states. The dynamics of many-body systems must satisfy cluster separability requirements. In this paper we formulate an abstract…

Nuclear Theory · Physics 2017-08-23 F. Coester , W. N. Polyzou

Thermodynamic response functions, including the isothermal compressibility, the thermal pressure coefficient, and the thermal expansion coefficient, isochoric and isobaric heat capacities are explicitly derived for a many-particle system…

Statistical Mechanics · Physics 2025-11-27 M. P. Kozlovskii , O. A. Dobush , R. V. Romanik , I. V. Pylyuk , M. A. Shpot

A method based on separated integration to estimate anharmonic corrections to energy and vibration of molecules in a second-order diagrammatic vibrational many-body Green's function formalism has already been presented. A severe bottleneck…

Chemical Physics · Physics 2019-09-17 Prashant Rai , Khachik Sargsyan , Habib Najm , So Hirata

We give an introductory account of the recent hyperdensity functional theory for the equilibrium statistical mechanics of soft matter systems [F. Samm\"uller et al., Phys. Rev. Lett. 133, 098201 (2024); 10.1103/PhysRevLett.133.098201].…

Soft Condensed Matter · Physics 2025-02-27 Florian Sammüller , Matthias Schmidt

Radiative energy and momentum transfer due to fluctuations of electromagnetic fields arising due to temperature difference between objects is described in terms of the cross-spectral densities of the electromagnetic fields. We derive…

Mathematical Physics · Physics 2013-02-05 Arvind Narayanaswamy , Yi Zheng

The electric conductance of a molecular junction is calculated by recasting the Keldysh formalism in Liouville space. Dyson equations for nonequilibrium many body Green's functions (NEGF) are derived directly in real (physical) time. The…

Quantum Physics · Physics 2007-05-23 U. Harbola , S. Mukamel

We describe how to apply the recursive Green's function method to the computation of electronic transport properties of graphene sheets and nanoribbons in the linear response regime. This method allows for an amenable inclusion of several…

Mesoscale and Nanoscale Physics · Physics 2013-06-18 Caio H. Lewenkopf , Eduardo R. Mucciolo

Starting with the Green's functions found for normal diffusion, we construct exact time-dependent Green's functions for subdiffusive equation (with fractional time derivatives), with the boundary conditions involving a linear combination of…

Statistical Mechanics · Physics 2009-11-10 Tadeusz Kosztolowicz

We explicitly calculate the Green functions describing quantum changes of topology in Friedman-Lemaitre-Robertson-Walker Universes whose spacelike sections are compact but endowed with distinct topologies. The calculations are performed…

General Relativity and Quantum Cosmology · Physics 2010-02-03 Jerome Martin , Nelson Pinto-Neto , Ivano Damiao Soares

We derive the equations of motion of an extended test body in the context of Einstein's theory of gravitation. The equations of motion are obtained via a multipolar approximation method and are given up to the quadrupolar order. Special…

General Relativity and Quantum Cosmology · Physics 2010-04-06 Jan Steinhoff , Dirk Puetzfeld

We construct the Green function for second-order elliptic equations in non-divergence form when the mean oscillations of the coefficients satisfy the Dini condition. We show that the Green's function is BMO in the domain and establish…

Analysis of PDEs · Mathematics 2021-08-24 Hongjie Dong , Seick Kim

Problems of finite-temperature quantum statistical mechanics can be formulated in terms of imaginary (Euclidean) -time Green's functions and self-energies. In the context of realistic Hamiltonians, the large energy scale of the Hamiltonian…

Statistical Mechanics · Physics 2018-08-17 Emanuel Gull , Sergei Iskakov , Igor Krivenko , Alexander A. Rusakov , Dominika Zgid

By introducing multipe-site correlation functions, we propose a hierarchical Green function approach, and apply it to study the characteristic properties of a 2D square lattice Hubbard model by solving the equation of motions of a…

Strongly Correlated Electrons · Physics 2018-09-26 Yu-Liang Liu

This paper introduces a probability density estimator based on Green's function identities. A density model is constructed under the sole assumption that the probability density is differentiable. The method is implemented as a binary…

Machine Learning · Statistics 2012-08-22 Peter Kovesarki , Ian C. Brock , A. Elizabeth Nuncio Quiroz

In calculating Green functions for interacting quantum systems numerically one often has to resort to finite systems which introduces a finite size level spacing. In order to describe the limit of system size going to infinity correctly,…

Strongly Correlated Electrons · Physics 2015-05-18 Peter Schmitteckert

Thermoelectric effects in a quantum dot coupled to the source and drain charge reservoirs are explored using a nonequilibrium Green's functions formalism beyond the Hartree-Fock approximation. Thermal transport is analyzed within a linear…

Materials Science · Physics 2014-03-18 Natalya A. Zimbovskaya

We prove that nonlinear Gibbs measures can be obtained from the corresponding many-body, grand-canonical, quantum Gibbs states, in a mean-field limit where the temperature T diverges and the interaction behaves as 1/T. We proceed by…

Mathematical Physics · Physics 2015-05-22 Mathieu Lewin , Phan Thành Nam , Nicolas Rougerie
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