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Due to their small size and unique properties, single-molecule electronics have long seen research interest from experimentalists and theoreticians alike. From a theoretical standpoint, modeling these systems using electronic structure…

Chemical Physics · Physics 2021-10-04 Andrew M. Sand , Justin T. Malme , Erik P. Hoy

We investigate the spectral function of fermions in a $p$-wave superconducting state, at finite both temperature and gravitational coupling, using the $AdS/CFT$ correspondence and extending previous research. We found that, for any coupling…

High Energy Physics - Theory · Physics 2017-10-10 G. L. Giordano , N. E. Grandi , A. R. Lugo

Relativistic energy density functionals (EDF) have become a standard tool for nuclear structure calculations, providing a complete and accurate, global description of nuclear ground states and collective excitations. Guided by the medium…

Nuclear Theory · Physics 2015-05-27 Tamara Niksic , Dario Vretenar , Peter Ring

We investigate transport of spinless fermions through a single site dot junction of M one-dimensional quantum wires. The semi-infinite wires are described by a tight-binding model. Each wire consists of two parts: the non-interacting leads…

Strongly Correlated Electrons · Physics 2009-11-11 X. Barnabe-Theriault , A. Sedeki , V. Meden , K. Schoenhammer

Density functional theory (DFT) became a universal approach to compute ground-state and excited configurations of many-electron systems held together by an external one-body potential in condensed-matter, atomic, and molecular physics. At…

Nuclear Theory · Physics 2011-09-30 J. Dobaczewski

Depending on the energy regime, the dynamics of heavy-ion collisions reveals a variety of different mechanisms which are attributed to the combination of collective and dissipative effects. Semi-classical approaches have been successful in…

Nuclear Theory · Physics 2022-03-28 Hung Dinh Viet , Paolo Napolitani

A density functional theory is proposed for strongly interacting fermions with arbitrary large negative scattering length. The functional has only two parameters that are directly fixed to reproduce the universal properties of unitary gas:…

Nuclear Theory · Physics 2016-11-03 Denis Lacroix

The various thermodynamic functions dependence on degree of energy band occupation and temperature was studied. The one-band tight binding approximation for the electron energy spectrum was used. The Fermi energy, density of states,…

Statistical Mechanics · Physics 2010-10-11 B. V. Karpenko , A. V. Kuznetzov , V. V. Dyakin

We have thoroughly characterized the surfaces of the organic charge-transfer salts TTF-TCNQ and (TMTSF)2PF6 which are generally acknowledged as prototypical examples of one-dimensional conductors. In particular x-ray induced photoemission…

Condensed Matter · Physics 2009-11-07 M. Sing , U. Schwingenschlogl , R. Claessen , M. Dressel , C. S. Jacobsen

The effect of static fluctuations in the phase of the order parameter on the normal and superconducting properties of a 2D system with attractive four-fermion interaction is studied. Analytic expressions for the fermion Green's function,…

Superconductivity · Physics 2009-10-31 Valery P. Gusynin , Vadim M. Loktev , Sergei G. Sharapov

Temperature variations of the heat capacity (C) are studied in a low temperature regime for 2D-, and 3D-systems with N~100-10000 treated as a canonical ensemble of N-noninteracting fermions. The analysis of C is performed by introducing…

Mesoscale and Nanoscale Physics · Physics 2008-12-01 N. K. Kuzmenko , V. M. Mikhajlov

The real-time electronic dynamics on material surfaces is critically important to a variety of applications. However, their simulations have remained challenging for conventional methods such as the time-dependent density-functional theory…

Chemical Physics · Physics 2015-06-16 Rulin Wang , Dong Hou , Xiao Zheng

In the density functional (DF) theory of Kohn and Sham, the kinetic energy of the ground state of a system of noninteracting electrons in a general external field is calculated using a set of orbitals. Orbital free methods attempt to…

Strongly Correlated Electrons · Physics 2009-11-13 Jeng-Da Chai , John D Weeks

Density functional theory underlies the most successful and widely used numerical methods for electronic structure prediction of solids. However, it has the fundamental shortcoming that the universal density functional is unknown. In…

Disordered Systems and Neural Networks · Physics 2020-09-23 M. Michael Denner , Mark H. Fischer , Titus Neupert

Spectral functions encode a wealth of information about the dynamics of any given system, and the determination of their non-perturbative characteristics is a long-standing problem in quantum field theory. Whilst numerical simulations of…

High Energy Physics - Lattice · Physics 2022-11-03 Peter Lowdon , Owe Philipsen

In this paper, we systematically investigate the general spin-one dark matter-nucleus interactions within the framework of effective field theories (EFT). We consider both the nonrelativistic (NR) and the relativistic EFT descriptions of…

High Energy Physics - Phenomenology · Physics 2026-02-12 Jin-Han Liang , Yi Liao , Xiao-Dong Ma , Hao-Lin Wang

Multi-pulse nonlinear THz spectroscopies enable a new understanding of interacting metallic systems via their sensitivity to novel correlation functions. Here, we investigated the THz nonlinear properties of the dilute metallic phase of…

Strongly Correlated Electrons · Physics 2025-01-28 K. Santhosh Kumar , David Barbalas , Rishi Bhandia , Dooyong Lee , Shivasheesh Varshney , Bharat Jalan , N. P. Armitage

The structural, dynamical, and thermodynamical properties of diamond, graphite and layered derivatives (graphene, rhombohedral graphite) are computed using a combination of density-functional theory (DFT) total-energy calculations and…

Materials Science · Physics 2009-11-10 Nicolas Mounet , Nicola Marzari

In the last 10 years, we have observed an important increase of interest in the application of time-dependent energy density functional theory (TD-EDF). This approach allows to treat nuclear structure and nuclear reaction from small to…

Nuclear Theory · Physics 2015-10-28 Denis Lacroix , Yusuke Tanimura , Guillaume Scamps , Cédric Simenel

The derivative discontinuity of the exchange-correlation (xc) energy at integer particle number is a property of the exact, unknown xc functional of density functional theory (DFT) which is absent in many popular local and semilocal…

Strongly Correlated Electrons · Physics 2015-06-11 Gao Xianlong , A-Hai Chen , I. V. Tokatly , S. Kurth
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