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A comprehensive theoretical understanding of electron-photon correlation is essential for describing the reshaping of molecular orbitals in quantum electrodynamics (QED) environments. The strong coupling QED Hartree-Fock (SC-QED-HF) theory…

Chemical Physics · Physics 2024-09-04 Yassir El Moutaoukal , Rosario R. Riso , Matteo Castagnola , Henrik Koch

The development of reliable ab initio methods for light-matter strong coupling is necessary for a deeper understanding of molecular polaritons. The recently developed strong coupling quantum electrodynamics Hartree-Fock model (SC-QED-HF)…

Chemical Physics · Physics 2025-02-21 Matteo Castagnola , Rosario R. Riso , Yassir El Moutaoukal , Enrico Ronca , Henrik Koch

Coupling between molecules and vacuum photon fields inside an optical cavity has proven to be an effective way to engineer molecular properties, in particular reactivity. To ease the rationalization of cavity induced effects we introduce an…

Chemical Physics · Physics 2022-04-06 Rosario R. Riso , Tor S. Haugland , Enrico Ronca , Henrik Koch

Recently developed strong-coupling theory open up the possibility of treating quantum-mechanical systems with hard-wall potentials via perturbation theory. To test the power of this theory we study here the exactly solvable quantum…

Condensed Matter · Physics 2009-10-31 H. Kleinert , A. Chervyakov , B. Hamprecht

We explore the non-Hermitian extension of quantum chemistry in the complex plane and its link with perturbation theory. We observe that the physics of a quantum system is intimately connected to the position of complex-valued energy…

Chemical Physics · Physics 2021-06-14 Antoine Marie , Hugh G. A. Burton , Pierre-François Loos

We present a full introduction to the recent devised perturbation theory for strong coupling in quantum mechanics. In order to put the theory in a proper historical perspective, the approach devised in quantum field theory is rapidly…

Quantum Physics · Physics 2007-05-23 Marco Frasca

An efficient perturbational treatment of spin-orbit coupling within the framework of high-level multi-reference techniques has been implemented in the most recent version of the COLUMBUS quantum chemistry package, extending the existing…

Interacting electrons in a semiconductor quantum dot at strong magnetic fields exhibit a rich set of states, including correlated quantum fluids and crystallites of various symmetries. We develop in this paper a perturbative scheme based on…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Gun Sang Jeon , Chia-Chen Chang , Jainendra K. Jain

A short overview of studies of strong coupling problems in hadron physics is presented. The Schwinger-Dyson/Bethe-Salpeter approach in the continuum allows the perturbative regime to be connected to the world of strong coupling that…

High Energy Physics - Phenomenology · Physics 2009-06-08 M. R. Pennington

We investigate the scalar perturbations and the possible strong coupling issues of $f(T)$ around a cosmological background, applying the effective field theory (EFT) approach. We revisit the generalized EFT framework of modified…

General Relativity and Quantum Cosmology · Physics 2023-11-22 Yu-Min Hu , Yaqi Zhao , Xin Ren , Bo Wang , Emmanuel N. Saridakis , Yi-Fu Cai

We calculate vacuum polarization corrections to the binding energies in neutral alkali atoms Na through to the superheavy element E119. We employ the relativistic Hartree-Fock method to demonstrate the importance of relaxation of the…

Atomic Physics · Physics 2016-05-04 J. S. M. Ginges , J. C. Berengut

We investigate the accuracy of a number of wavefunction based methods at the heart of quantum chemistry for metallic systems. Using Hartree-Fock as a reference, perturbative (M{\o}ller-Plesset, MP) and coupled cluster (CC) theories are used…

Chemical Physics · Physics 2013-10-24 James J. Shepherd , Andreas Grüneis

The relativistic Hartree-Fock and electron correlation methods without the negative-energy orbital problem are examined on the basis of the quantum electrodynamics (QED) Hamiltonian. First, several QED Hamiltonians previously proposed are…

Chemical Physics · Physics 2023-01-02 Nobuki Inoue , Yoshihiro Watanabe , Haruyuki Nakano

Recent experimental progress in the field of cavity quantum electrodynamics allows to study the regime of strong interaction between quantized light and complex matter systems. Due to the coherent coupling between photons and matter-degrees…

Quantum Physics · Physics 2021-02-24 Florian Buchholz

The theory of the strong interactions, Quantum Chromodynamics (QCD), has been addressed by a variety of non-perturbative techniques over the decades since its introduction. We have investigated Hamiltonian formulations with different…

High Energy Physics - Theory · Physics 2007-05-23 J. P. Vary , T. J. Fields J. R. Spence , H. W. L. Naus , H. J. Pirner , K. S. Gupta

We investigate the strong coupling problem in modified teleparallel gravity theories using the effective field theory (EFT) approach, demonstrating that it is possible to shift the emergence of new degrees of freedom (DoFs) to lower orders…

General Relativity and Quantum Cosmology · Physics 2024-10-07 Yu-Min Hu , Bi-Chu Li , Yang Yu , Martin Krššák , Emmanuel N. Saridakis , Yi-Fu Cai

An evaluation of the effective QED coupling at the scale M_Z is presented. It employs the predictions of perturbative QCD for the cross section of electron positron annihilation into hadrons up to order \alpha_s^2, including the full quark…

High Energy Physics - Phenomenology · Physics 2009-10-31 J. H. Kühn , M. Steinhauser

We present the reaction-coordinate polaron-transform (RCPT) framework for generating effective Hamiltonian models to treat nonequilibrium open quantum systems at strong coupling with their surroundings. Our approach, which is based on two…

Quantum Physics · Physics 2022-11-11 Nicholas Anto-Sztrikacs , Ahsan Nazir , Dvira Segal

We give an introduction to the special problems encountered in a treatment of HQET beyond perturbation theory in the gauge coupling constant. In particular, we report on a recent test of HQET as an effective theory for QCD and discuss how…

High Energy Physics - Phenomenology · Physics 2011-01-27 Rainer Sommer

We present a novel method that appropriately handles both dynamical and static electron correlation in a balanced manner, using a perturbation theory on a spin-extended Hartree-Fock (EHF) wave function reference. While EHF is a suitable…

Strongly Correlated Electrons · Physics 2015-06-22 Takashi Tsuchimochi , Troy Van Voorhis
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