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Related papers: Density functionals derived from Feynman diagrams

200 papers

Approximate molecular calculations via standard Kohn-Sham Density Functional Theory are exactly reproduced by performing self-consistent calculations on isolated fragments via Partition Density Functional Theory [Phys. Rev. A 82, 024501…

Other Condensed Matter · Physics 2016-11-25 Jonathan Nafziger , Qin Wu , Adam Wasserman

A generalization of the Kohn--Sham approach is derived where the correlation-energy functional depends on the one-particle density matrix of noninteracting states and on the external potential from the interacting target-state. The…

Chemical Physics · Physics 2007-05-23 James P. Finley

Wigner functions are broadly used to probe non-classical effects in the macroscopic world. Here we develop an orbital-free functional framework to compute the 1-body Wigner quasi-probability for both fermionic and bosonic systems. Since the…

Strongly Correlated Electrons · Physics 2024-01-18 Carlos L. Benavides-Riveros

I summarize Density Functional Theory (DFT) in a language familiar to quantum field theorists, and introduce several apparently novel ideas for constructing {\it systematic} approximations for the density functional. I also note that, at…

Materials Science · Physics 2015-03-11 T. Banks

We derive transport equations for fermions and bosons in spatially or temporally varying backgrounds with special symmetries, by use of the Schwinger-Keldysh formalism. In a noninteracting theory the coherence information is shown to be…

High Energy Physics - Phenomenology · Physics 2014-11-18 Matti Herranen , Kimmo Kainulainen , Pyry M. Rahkila

The partition function of composite bosons ("cobosons" for short) is calculated in the canonical ensemble, with the Pauli exclusion principle between their fermionic components included in an exact way through the finite temperature…

Statistical Mechanics · Physics 2016-12-13 Shiue-Yuan Shiau , Monique Combescot , Yia-Chung Chang

We study quantum mechanics in the stochastic formulation, using the functional integral approach. The noise term enters the classical action as a local contribution of anticommuting fields. The partition function is not invariant under…

High Energy Physics - Lattice · Physics 2013-11-15 S. Nicolis

The grand canonical density functional theory for inhomogeneous systems of interacting bosons is developed in the effective action approach. The Legendre transform of the generating functional for Green's functions is used to define the…

Quantum Gases · Physics 2023-07-03 Anna Okopińska

We introduce a general class of generating functionals for the calculation of quantum-mechanical expectation values of arbitrary functionals of fluctuating paths with fixed end points in configuration or momentum space. The generating…

Quantum Physics · Physics 2009-10-31 Hagen Kleinert , Axel Pelster , Michael Bachmann

The partition function for a system of non-interacting $N-$particles can be found by summing over all the states of the system. The classical partition function for an ideal gas differs from Bosonic or Fermionic partition function in the…

Physics Education · Physics 2021-04-06 Sushil K. Singh , Savinder Kaur

Using density functional theory, we investigate fluctuations of the ground state energy of spin-polarized, disordered quantum dots in the metallic regime. To compare to experiment, we evaluate the distribution of addition energies and find…

Mesoscale and Nanoscale Physics · Physics 2009-10-31 K. Hirose , F. Zhou , N. Wingreen

Density functional theory, when applied to systems with $T\neq 0$, is based on the grand canonical extension of the Hohenberg-Kohn-Sham theorem due to Mermin (HKSM theorem). While a straightforward canonical ensemble generalization fails,…

Statistical Mechanics · Physics 2009-10-31 J. A. Hernando , L. Blum

Higher-order diagrams required for radiative corrections to mixed electroweak and QCD processes at the LHC and anticipated future colliders will require numerically stable representations of the associated Feynman diagrams. The…

Mathematical Physics · Physics 2011-10-25 S. A. Yost , V. V. Bytev , M. Yu. Kalmykov , B. A. Kniehl , B. F. L. Ward

When calculating higher terms of the epsilon-expansion of massive Feynman diagrams, one needs to evaluate particular cases of multiple inverse binomial sums. These sums are related to the derivatives of certain hypergeometric functions with…

High Energy Physics - Theory · Physics 2008-11-26 A. I. Davydychev , M. Yu. Kalmykov

In the exact Kohn-Sham density-functional theory (DFT), the total energy versus the number of electrons is a series of linear segments between integer points. However, commonly used approximate density functionals produce total energies…

Materials Science · Physics 2013-04-03 Eli Kraisler , Leeor Kronik

Density functional theory (DFT) offers a desirable balance between quantitative accuracy and computational efficiency in practical many-electron calculations. Its central component, the exchange-correlation energy functional, has been…

We present for static density functional theory and time-dependent density functional theory calculations an all-electron method which employs high-order hierarchical finite element bases. Our mesh generation scheme, in which structured…

Materials Science · Physics 2009-08-06 Lauri Lehtovaara , Ville Havu , Martti Puska

Following Ref. [Oriols X 2007 Phys. Rev. Lett., 98 066803], an algorithm to deal with the exchange interaction in non-separable quantum systems is presented. The algorithm can be applied to fermions or bosons and, by construction, it…

Quantum Physics · Physics 2014-08-05 A. Alarcón , S. Yaro , X. Cartoixà , X. Oriols

Strongly interacting one-dimensional (1D) Bose-Fermi mixtures form a tunable XXZ spin chain. Within the spin-chain model developed here, all properties of these systems can be calculated from states representing the ordering of the bosons…

Quantum Gases · Physics 2017-04-25 F. Deuretzbacher , D. Becker , J. Bjerlin , S. M. Reimann , L. Santos

The generating functional of two dimensional $BF$ field theories coupled to fermionic fields and conserved currents is computed in the general case when the base manifold is a genus g compact Riemann surface. The lagrangian density…

High Energy Physics - Theory · Physics 2009-10-31 A. Restuccian , J. Stephany
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