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We study the effect of semicore states on the self-energy corrections and electronic energy gaps of silicon, germanium and GaAs. Self-energy effects are computed within the GW approach, and electronic states are expanded in a plane-wave…

Materials Science · Physics 2009-11-10 Murilo L. Tiago , Sohrab Ismail-Beigi , Steven G. Louie

We perform \emph{ab initio} quantum Monte Carlo (QMC) simulations of the warm dense uniform electron gas in the thermodynamic limit. By combining QMC data with linear response theory we are able to remove finite-size errors from the…

We study a specific correction to the Bethe logarithm induced by potentials which are proportional to a Dirac-delta function in coordinate space ("local potentials"). Corrections of this type occur naturally in the calculation of various…

High Energy Physics - Phenomenology · Physics 2009-11-10 Ulrich D. Jentschura

The screened QED corrections of the first orders in \alpha and 1/Z to the g factor and the hyperfine splitting of lithiumlike ions are evaluated within ab initio quantum electrodynamical approach. The complete gauge-invariant set of the…

Atomic Physics · Physics 2014-11-18 D. A. Glazov , A. V. Volotka , V. M. Shabaev , I. I. Tupitsyn , G. Plunien

The quantum Rabi model (QRM) is a cornerstone in the study of light-matter interactions within cavity and circuit quantum electrodynamics (QED). It effectively captures the dynamics of a two-level system coupled to a single-mode resonator,…

We present a relativistic correction scheme to improve the accuracy of 1s core-level binding energies calculated from Green's function theory in the $GW$ approximation, which does not add computational overhead. An element-specific…

Chemical Physics · Physics 2020-09-23 Levi Keller , Volker Blum , Patrick Rinke , Dorothea Golze

We report the implementation of effective QED potentials for all-electron 4-component relativistic molecular calculations using the DIRAC code. The potentials are also available for 2-component calculations, proper picture-change being…

Chemical Physics · Physics 2022-11-09 Ayaki Sunaga , Maen Salman , Trond Saue

We explore a separable resolution-of-the-identity formalism built on quadratures over limited sets of real-space points designed for all-electron calculations. Our implementation preserves in particular the use of common atomic orbitals and…

Chemical Physics · Physics 2019-05-22 Ivan Duchemin , Xavier Blase

We introduce a new Projected Rayleigh Quotient Iteration aimed at improving the convergence behaviour of classic Rayleigh Quotient iteration (RQI) by incorporating approximate information about the target eigenvector at each step. While…

Numerical Analysis · Mathematics 2024-11-13 Nils Friess , Alexander D. Gilbert , Robert Scheichl

The Variational Quantum Eigensolver (VQE) is one of the most promising algorithms for current quantum devices. It employs a classical optimizer to iteratively update the parameters of a variational quantum circuit in order to search for the…

Quantum Physics · Physics 2025-11-19 Chenyu Shi , Hao Wang

The two-loop self-energy correction to the bound-electron $g$-factor in hydrogenlike ions is investigated, taking into account the electron-nucleus interaction exactly. This all-order calculation is required to improve the total theoretical…

Atomic Physics · Physics 2025-05-01 Bastian Sikora , Vladimir A. Yerokhin , Christoph H. Keitel , Zoltán Harman

The field theoretic renormalization study of reduced quantum electrodynamics (QED) is performed up to two loops. In the condensed matter context, reduced QED constitutes a very natural effective relativistic field theory describing (planar)…

High Energy Physics - Theory · Physics 2018-04-05 S. Teber , A. V. Kotikov

We suggest that at any given order of Feynman diagram calculation all renormalization group (RG)-predictable terms should be resummed to all-orders. This ``complete'' RG-improvement (CORGI) serves to separate the perturbation series into…

High Energy Physics - Phenomenology · Physics 2007-05-23 C. J. Maxwell

Within the framework of QED theory at finite temperature the thermal radiative corrections to spontaneous one-photon transition rates in hydrogen atom are investigated. The radiative one-loop self-energy corrections are described in the…

Atomic Physics · Physics 2020-05-13 T. Zalialiutdinov , D. Solovyev , L. Labzowsky

The use of resonant depolarization has been suggested for precise beam energy measurements (better than 100 keV) in the $e^{+}e^{-}$ Future Circular Collider (FCC-$e^{+}e^{-}$) for Z and WW physics at 45 and 80 GeV beam energy respectively.…

Accelerator Physics · Physics 2017-05-09 E. Gianfelice-Wendt

Power-suppressed corrections coming from the end-point integration regions in the amplitude of the process $\gamma^{*}\gamma \to \pi \pi$ at large $Q^2$ and small squared center-of-mass energy $W^2$ are calculated in the QCD hard-scattering…

High Energy Physics - Phenomenology · Physics 2009-11-10 S. S. Agaev , M. Guidal , B. Pire

The leading long-distance 1-loop quantum corrections to the Coulomb potential are derived for scalar QED and their gauge-independence is explicitly checked. The potential is obtained from the direct calculation of the 2-particle scattering…

High Energy Physics - Theory · Physics 2009-10-31 J. A. Helayel-Neto , A. Penna-Firme , I. L. Shapiro

We apply the renormalized singles with correlation (RSc) Green's function in the $GW$ approximation to calculate accurate quasiparticle (QP) energies and orbitals. The RSc Green's function includes all orders of singles contributions from…

Chemical Physics · Physics 2022-10-19 Jiachen Li , Weitao Yang

We introduce the Real Quantum Amplitude Estimation (RQAE) algorithm, an extension of Quantum Amplitude Estimation (QAE) which is sensitive to the sign of the amplitude. RQAE is an iterative algorithm which offers explicit control over the…

Quantum Physics · Physics 2022-05-26 Alberto Manzano , Daniele Musso , Álvaro Leitao

We present results on the self-energy correction to the energy levels of hydrogen and hydrogenlike ions. The self energy represents the largest QED correction to the relativistic (Dirac-Coulomb) energy of a bound electron. We focus on the…