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Simulating entangled atoms is a prerequisite to modeling quantum materials and remains an outstanding challenge for theory. I introduce a correlated wavefunction approach capable of simulating large entangled systems, and demonstrate its…

Chemical Physics · Physics 2026-01-05 Benjamin G. Janesko

Motivated by recent suggestions --to split the electron-electron interaction into a short-range part, to be treated within the density functional theory, and a long-range part, to be handled by other techniques-- we compute, with a…

Materials Science · Physics 2009-11-10 Lorenzo Zecca , Paola Gori-Giorgi , Saverio Moroni , Giovanni B. Bachelet

In the recent work of S. Sharma \emph{et al.}, (arxiv.org: arxiv:0912.1118), a single-electron spectrum associated with the natural orbitals was defined as the derivative of the total energy with respect to the occupation numbers at half…

Chemical Physics · Physics 2012-03-07 E. N. Zarkadoula , S. Sharma , J. K. Dewhurst , E. K. U. Gross , N. N. Lathiotakis

The relation of quarteting and clustering in atomic nuclei is discussed based on symmetry-considerations. This connection enables us to predict a complete high-energy cluster spectrum from the description of the low-energy quartet part. As…

Nuclear Theory · Physics 2016-05-04 J. Cseh , G. Riczu

A substantial fraction of systematic uncertainties in neutrino oscillation experiments stems from the lack of precision in modeling the nucleus when describing the neutrino-nucleus interactions. The Spectral Function (SF) model features a…

High Energy Physics - Phenomenology · Physics 2022-08-29 Jaafar Chakrani , Margherita Buizza Avanzini , Stephen Dolan

Cluster Perturbation Theory (CPT) is a computationally economic method commonly used to estimate the momentum and energy resolved single-particle Green's function. It has been used extensively in direct comparisons with experiments that…

Strongly Correlated Electrons · Physics 2020-02-20 P. T. Raum , G. Alvarez , Thomas Maier , V. W. Scarola

This chapter discusses correlation analysis of stationary multivariate Gaussian time series in the spectral or Fourier domain. The goal is to identify the hub time series, i.e., those that are highly correlated with a specified number of…

Other Statistics · Statistics 2014-04-10 Hamed Firouzi , Dennis Wei , Alfred O. Hero

We propose an approach to build `full-frequency' quasiparticle spectra from conservation of a set of static expectation values. These expectation values define the moments of the spectral distribution, resulting in an efficient and…

Chemical Physics · Physics 2022-10-27 Oliver J. Backhouse , George H. Booth

A method to calculate particle fluxes applicable in most of the spectroscopy techniques is described. Flux intensities of backscattered or absorbed electrons and emitted photons are calculated using a method of convergence to solve the…

Materials Science · Physics 2015-06-05 C. Figueroa , N. Nieva , H. Brizuela , S. P. Heluani

According to recent Quantum Monte Carlo simulations the small polaron theory is practically exact in a wide range of the long-range (Frohlich) electron-phonon coupling and adiabatic ratio. We apply the Lang-Firsov transformation to convert…

Superconductivity · Physics 2009-10-31 A. S. Alexandrov , C. Sricheewin

We obtain sequences of inclusion sets for the spectrum, essential spectrum, and pseudospectrum of banded, in general non-normal, matrices of finite or infinite size. Each inclusion set is the union of the pseudospectra of certain…

Spectral Theory · Mathematics 2023-06-21 Simon N. Chandler-Wilde , Ratchanikorn Chonchaiya , Marko Lindner

The spectral functions for calcium and argon are constructed. It is verified that their predictions for the quasielastic electron-nucleus cross sections in the energy range ~1 GeV agree with the data. The argon spectral function is then…

Nuclear Theory · Physics 2008-11-26 Artur M. Ankowski , Jan T. Sobczyk

A general method for calculating statistical properties of speckle patterns of coherent waves propagating in disordered media is developed. It allows one to calculate speckle pattern correlations in space, as well as their sensitivity to…

Disordered Systems and Neural Networks · Physics 2009-11-13 Oded Agam , Anton Andreev , Boris Spivak

This chapter describes the relationship between low frequency noise and coherence decay of localized spins in semiconductors. Section 2 establishes a direct relationship between an arbitrary noise spectral function and spin coherence as…

Mesoscale and Nanoscale Physics · Physics 2009-09-05 Rogerio de Sousa

When electron correlations are important it is often necessary to use numerical methods to solve the Hamiltonian for a finite system (cluster) "exactly". Unfortunately, such methods are restricted to small systems. We propose to combine the…

Strongly Correlated Electrons · Physics 2009-10-31 Maciej M. Maska

We consider the reflected entropy and the associated entanglement spectrum for free fermions reduced to two intervals in 1+1 dimensions. Working directly in the continuum theory the reflected entropy can be extracted from the spectrum of a…

High Energy Physics - Theory · Physics 2023-03-22 Souvik Dutta , Thomas Faulkner , Simon Lin

The determination of spectral properties from first principles can provide powerful connections between microscopic theoretical predictions and experimental data, but requires complex electronic-structure formulations that fall outside the…

Materials Science · Physics 2014-09-16 Ngoc Linh Nguyen , Giovanni Borghi , Andrea Ferretti , Ismaila Dabo , Nicola Marzari

The ground state and the excitation spectrum of strongly correlated electrons in quantum dots are investigated. An analytical solution is constructed by exact diagonalization of the Hamiltonian in terms of the $N$-particle eigenmodes.

Strongly Correlated Electrons · Physics 2009-11-11 K. Balzer , C. Nölle , M. Bonitz , A. Filinov

Methods to detect the spectral sensitivity of an object using undulator radiation without monochromators or any other spectral devices are developed. The spectral transmission function of the object is calculated from its response to the…

Accelerator Physics · Physics 2007-05-23 A. F. Medvedev , M. L. Schinkeev

We develop a model that establishes a quantitative link between the physical properties of molecular aggregates and their constituent building blocks. The relation is built on the coherent potential approximation, calibrated against exact…

Chemical Physics · Physics 2017-01-11 Aurélia Chenu , Jianshu Cao