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相关论文: Natural optical activity from density-functional p…

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The optical manifold method to compute the one-loop effective action in a static space-time is extended from the massless scalar field to the Maxwell field in any Feynman-like covariant gauge. The method is applied to the case of the…

高能物理 - 理论 · 物理学 2014-11-18 Valter Moretti , Devis Iellici

The objective of this paper is to investigate a new numerical method for the approximation of the self-diffusion matrix of a tagged particle process defined on a grid. While standard numerical methods make use of long-time averages of…

数值分析 · 数学 2023-02-27 Jad Dabaghi , Virginie Ehrlacher , Christoph Strössner

The object of this work is the numerical investigation of a non-commutative field theory defined via the spectral action principle. The Starting point is a spectral triple (A,H,D) referred to as harmonic. The construction of these data…

数学物理 · 物理学 2011-11-15 Bernardino Spisso

An analytical solution for the optical efficiency of a luminescent solar concentrator is presented. Due to a large number of input parameters and their complex effect on the device efficiency numerical simulations have been previously used…

光学 · 物理学 2020-03-16 Ilya Sychugov

In this work we introduced a new proposal to study the gravitational lensing theory by spherical lenses, starting from its surface mass density $\Sigma(x)$ written in terms of a decreasing function $f$ of a dimensionless coordinate $x$ on…

宇宙学与河外天体物理 · 物理学 2014-07-21 Roger Hurtado , Leonardo Castaneda , Juan M. Tejeiro

The energy- and density-dependent single-particle potential for nucleons is constructed in a medium of infinite isospin-symmetric nuclear matter starting from realistic nuclear interactions derived within the framework of chiral effective…

核理论 · 物理学 2014-10-24 J. W. Holt , N. Kaiser , G. A. Miller , W. Weise

Right- and left-handed circularly polarized light interact differently with electronic charges in chiral materials. This asymmetry generates the natural circular dichroism and gyrotropy, also known as the optical activity. Here we…

The development of variational density functional theory approaches to excited electronic states is impeded by limitations of the commonly used self-consistent field (SCF) procedure. A method based on a direct optimization approach as well…

化学物理 · 物理学 2022-11-09 Gianluca Levi , Aleksei V. Ivanov , Hannes Jónsson

This paper deals with the problem of inferring the signals and parameters that cause neural activity to occur. The ultimate challenge being to unveil brain's connectivity, here we focus on a microscopic vision of the problem, where single…

统计计算 · 统计学 2015-11-13 Pau Closas , Antoni Guillamon

We calculate optical forces and torques exerted on a chiral dipole by chiral light fields and reveal genuinely chiral forces in combining the chiral contents of both light field and dipolar matter. Here, the optical chirality is…

Working in the crystal-momentum representation, we calculate the optical conductivity of noncentrosymmetric insulating crystals at first order in the wave vector of light. The time-even part of this tensor describes natural optical activity…

介观与纳米尺度物理 · 物理学 2010-12-30 Andrei Malashevich , Ivo Souza

Standard density functional approximations often give questionable results for odd-electron radical complexes, with the error typically attributed to self-interaction. In density corrected density functional theory (DC-DFT), certain classes…

化学物理 · 物理学 2015-06-19 Min-Cheol Kim , Eunji Sim , Kieron Burke

The first order gradient correction to the Thomas-Fermi functional, proposed by Haq, Chattaraj and Deb (Chem. Phys. Lett. vol. 81, 8031, 1984) has been studied by evaluating both the total kinetic energy and the local kinetic energy…

其他凝聚态物理 · 物理学 2015-05-13 David Garcia-Aldea , T. Martin-Blas , J. E. Alvarellos

In an optically active medium, such as a plasma that contains a neutrino background, the left-handed and right-handed polarization photon modes acquire different dispersion relations. We study the propagation of photons in such a medium,…

高能物理 - 唯象学 · 物理学 2024-03-28 José F. Nieves , John D. Verges

We report extremely strong optical activity and circular dichroism exhibited by subwavelength arrays of four-start-screw holes fabricated with one-pass focused ion beam milling of freely suspended silver films. Having the fourth order…

光学 · 物理学 2015-06-19 M. V. Gorkunov , A. A. Ezhov , V. V. Artemov , O. Y. Rogov , S. G. Yudin

The optical potential is a powerful instrument for calculations on a wide variety of nuclear reactions, in particular, for quasi-elastic lepton-nucleus scattering. Phenomenological optical potentials are successful in the description of…

核理论 · 物理学 2017-07-13 Carlotta Giusti

The exchange-correlation energy in Kohn-Sham density functional theory is expressed as a functional of the electronic density and the Kohn-Sham orbitals. An alternative to Kohn-Sham theory is to express the energy as a functional of the…

计算物理 · 物理学 2009-10-31 S. Goedecker , C. Umrigar

The optical spectra of CeO2 have been systematically investigated using three first-principles computational approaches for comparison, namely, the Heyd-Scuseria-Ernzerhof (HSE) screened hybrid functional, HSE+\emph{U}, and…

强关联电子 · 物理学 2010-01-19 Hongliang Shi , Ping Zhang , Shu-Shen Li

It is known that optical activities can perform rotations. It is shown that the rotation, if modulated by attenuations, can perform symmetry operations of Wigner's little group which dictates the internal space-time symmetries of elementary…

数学物理 · 物理学 2015-05-13 Y. S. Kim

Dense active matter, in the fluid or amorphous-solid form, has generated intense interest as a model for the dynamics inside living cells and multicellular systems. An extension of the random first-order transition theory (RFOT) to include…

软凝聚态物质 · 物理学 2021-02-16 Rituparno Mandal , Saroj Kumar Nandi , Chandan Dasgupta , Peter Sollich , Nir S. Gov