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相关论文: Influence of Three-Body Effects on Halogen Bonding

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We present a new analysis of exchange and dispersion effects for calculating halogen-bonding interactions in a wide variety of complex dimers (69 total) within the XB18 and XB51 benchmark sets. Contrary to previous work on these systems, we…

化学物理 · 物理学 2018-03-07 Lindsey N. Anderson , Fredy W. Aquino , Alexandra E. Raeber , Xi Chen , Bryan M. Wong

Halogen bond (X-bond) is a noncovalent interaction between a halogen atom and an electron donor. It is often rationalized by a region of the positive electrostatic potential on the halogen atom, so-called $\sigma$-hole. The X-bond strength…

化学物理 · 物理学 2020-06-04 Michal H. Kolář , Denisa Suchá , Michal Pitoňák

Ab initio calculations have been carried out to study the magnetic dipole and electric quadrupole hyperfine structure constants of $^{205}$Pb$^+$. Many-body effects have been considered to all orders using the relativistic coupled-cluster…

原子物理 · 物理学 2015-06-26 Sonjoy Majumder , B. K. Sahoo , R. K. Chaudhuri , B. P. Das , D. Mukherjee

The Bethe-Salpeter equation for three bosons with zero-range interaction is solved for the first time. For comparison the light-front equation is also solved. The input is the two-body scattering length and the outputs are the three-body…

核理论 · 物理学 2017-05-24 E. Ydrefors , J. H. Alvarenga Nogueira , V. Gigante , T. Frederico , V. A. Karmanov

We report a theoretical study on the long-range additive and nonadditive potentials for a three-body hybrid atom-atom-ion system composed of one ground $S$ state Li atom, one excited $P$ state Li atom and one ground $S$ state Li$^+$ ion,…

原子物理 · 物理学 2021-09-02 Pei-Gen Yan , Li-Yan Tang , Zong-Chao Yan , James F. Babb

We propose a physically motivated decomposition of DFT 3-body nonadditive interaction energies into the exchange and density-deformation (polarization) components. The exchange component represents the effect of the Pauli exclusion in the…

We consider weakly interacting bosonic gases with local and non-local multi-body interactions. By using the Bogoliubov approximation, we first investigate contact interactions, studying the case in which the interparticle potential can be…

量子气体 · 物理学 2017-10-10 D. Laghi , T. Macrì , A. Trombettoni

The three body (triple dipole) interaction of Axilrod, Teller and Muto (ATM) contributes 5 to 10 % of the total energy of condensed phases of inert elements. It is shown in this paper for clusters and films that a much larger or smaller ATM…

软凝聚态物质 · 物理学 2009-11-10 Silvina M. Gatica , M. Mercedes Calbi , Milton W. Cole , Darrell Velegol

We derive three-body equations valid at finite densities and temperatures. These are based on the cluster mean field approach consistently including proper self energy corrections and the Pauli blocking. As an application we investigate the…

核理论 · 物理学 2009-10-31 M. Beyer , W. Schadow , C. Kuhrts , G. Roepke

Positron binding energies in halogenated hydrocarbons are calculated \emph{ab initio} using many-body theory. For chlorinated molecules, including planars for which the interaction is highly anisotropic, very good to excellent agreement…

化学物理 · 物理学 2024-04-24 J. P. Cassidy , J. Hofierka , B. Cunningham , C. M. Rawlins , C. H. Patterson , D. G. Green

In this paper, we studied a dilute quasi two-dimensional dipolar Bose-condensed with two- and three-body contact, and Coulomb interactions using the Hartree-Fock-Bogoliubov-Popov approximation. We analyze numerically the effects of…

量子气体 · 物理学 2022-03-02 S. Mostafa Moniri , Heshmatollah Yavari , Elnaz Darsheshdar

In the strangeness $S=-2$ sector, we study the $\Xi^{-}nn$ ($I=3/2, J^P={1/2}^+$) three-body system using pionless halo effective field theory (EFT), which provides a systematic model independent framework for assessing the feasibility of…

核理论 · 物理学 2021-04-30 Ghanashyam Meher , Udit Raha

We discuss renormalization of the non-relativistic three-body problem with short-range forces. The problem is non-perturbative at momenta of the order of the inverse of the two-body scattering length. An infinite number of graphs must be…

核理论 · 物理学 2009-10-31 P. F. Bedaque , H. -W. Hammer , U. van Kolck

The recombination of halogen atoms has been a research topic in chemical physics for over a century. All theoretical descriptions of atom recombination depend on a two-step assumption, where two colliding atoms first form an unstable…

原子物理 · 物理学 2025-04-16 Rian Koots , Grace Ding , Jesús Pérez-Ríos

Three body systems with short-range interactions display universal features that have been extensively explored in atomic physics, but apply to hadron physics as well. Systems composed of two non-interacting identical particles (species H)…

高能物理 - 唯象学 · 物理学 2018-07-19 Manuel Pavon Valderrama

Basis set convergence of correlation effects on molecular atomization energies beyond the CCSD (coupled cluster with singles and doubles) approximation has been studied near the one-particle basis set limit. Quasiperturbative connected…

化学物理 · 物理学 2008-08-17 Amir Karton , Peter R. Taylor , Jan M. L. Martin

We show that for ultra-cold neutral bosonic atoms held in a three-dimensional periodic potential or optical lattice, a Hubbard model with dominant, attractive three-body interactions can be generated. In fact, we derive that the effect of…

量子气体 · 物理学 2016-05-04 Saurabh Paul , P. R. Johnson , Eite Tiesinga

Background: The calculation of the hyperon binding energy in hypernuclei is crucial to understanding the interaction between hyperons and nucleons. Purpose: We assess the relative importance of two- and three-body hyperon-nucleon force by…

核理论 · 物理学 2013-12-16 D. Lonardoni , S. Gandolfi , F. Pederiva

Previous investigations of the three-body dynamics of $B$ mesons have shown that no Efimov effect arises in systems composed of three $B$ and $B^*$ mesons. This implies that the properties of such three-body systems can be described…

高能物理 - 唯象学 · 物理学 2026-05-19 Yong-Hui Lin , Hans-Werner Hammer , Ulf-G. Meißner

Energies of (2s2 2p5 3l3l') and (2s 2p6 3l3l') states for sodiumlike ions with Z =14--100 are evaluated to second order in relativistic many-body perturbation theory starting from a neonlike Dirac-Fock potential. Second-order Coulomb and…

原子物理 · 物理学 2009-11-07 U. I. Safronova , W. R. Johnson , M. S. Safronova , J. R. Albritton
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