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In material modeling, the calculation speed using the empirical potentials is fast compared to the first principle calculations, but the results are not as accurate as of the first principle calculations. First principle calculations are…

Computational Physics · Physics 2020-05-19 Moonseop Kim , Huayi Yin , Guang Lin

In this note we provide a second-order asymptotic expansion of the fractional perimeter Per$_s(E)$, as $s\to 1^-$, in terms of the local perimeter and of a higher order nonlocal functional.

Analysis of PDEs · Mathematics 2020-02-03 Annalisa Cesaroni , Matteo Novaga

We consider higher order frequentist inference for the parametric component of a semiparametric model based on sampling from the posterior profile distribution. The first order validity of this procedure established by Lee, Kosorok and Fine…

Statistics Theory · Mathematics 2009-09-29 Guang Cheng , Michael R. Kosorok

The spurious states found in numerical implementations of envelope function models for semiconductor heterostructures and nanostructures have been shown to be readily removed by employing a first-order difference scheme. This approach is…

Mesoscale and Nanoscale Physics · Physics 2015-10-29 William R. Frensley

Choosing the right first quantization basis in quantum optics is critical for the interpretation of experimental results. The usual frequency basis is, for instance, inappropriate for short, subcycle waveforms. Deriving first quantization…

Quantum Physics · Physics 2019-08-28 Stéphane Virally , Bertrand Reulet

Second-order statistics play a crucial role in analysing point processes. Previous research has specifically explored locally weighted second-order statistics for point processes, offering diagnostic tests in various spatial domains.…

Methodology · Statistics 2024-04-17 Nicoletta D'Angelo , Giada Adelfio , Jorge Mateu , Ottmar Cronie

We present a computationally efficient method to incorporate density-functional theory into the calculation of reflectivity in low-energy electron microscopy. The reflectivity is determined by matching plane waves representing the electron…

Materials Science · Physics 2013-11-13 John F. McClain , Jiebing Sun , Karsten Pohl , Jian-Ming Tang

Interpretation of time-resolved spectroscopies such as transient absorption (TA) or two-dimensional (2D) spectroscopy often relies on the perturbative description of light-matter interaction. In many cases the third order of nonlinear…

We derive the exact beyond-linear fluctuation dissipation relation, connecting the response of a generic observable to the appropriate correlation functions, for Markov systems. The relation, which takes a similar form for systems governed…

Statistical Mechanics · Physics 2008-07-03 E. Lippiello , F. Corberi , A. Sarracino , M. Zannetti

We adapted a recently proposed framework to characterize the optical response of interacting electrons in solids in order to expedite its computation without compromise in accuracy at the microscopic level. Our formulation is based on…

Materials Science · Physics 2021-03-02 Emilia Ridolfi , Paolo E. Trevisanutto , Vitor M. Pereira

We investigate the process of the second harmonic generation by plasmonic nano-antennas that exhibit Fano-like resonances. A rigorous fully vectorial Maxwell-hydrodynamics approach is employed to directly calculate the second order…

Optics · Physics 2022-09-27 Maxim Sukharev , Elena Drobnyh , Ruth Pachter

We propose a novel approach to model amorphous materials using a first principles density functional method while simultaneously enforcing agreement with selected experimental data. We illustrate our method with applications to amorphous…

Materials Science · Physics 2009-11-10 Parthapratim Biswas , De Nyago Tafen , Raymond Atta-Fynn , D. A. Drabold

The sinh-Gordon model on a half-line with integrable boundary conditions is considered in low order perturbation theory developed in affine Toda field theory. The quantum corrections to the classical reflection factor of the model are…

High Energy Physics - Theory · Physics 2009-11-07 A. Chenaghlou

We present experimental results on the observation of a bulk second-order nonlinear susceptibility derived from both free-space and integrated measurements in silicon nitride. Phase-matching is achieved through dispersion engineering of the…

The nonlinear response of stochastic models obeying a master equation is calculated up to fifth-order in the external field thus extending the third-order results obtained earlier (G. Diezemann, Phys. Rev. E{\bf 85}, 051502 (2012)). For…

Soft Condensed Matter · Physics 2017-08-30 Gregor Diezemann

We develop a principled approach to obtain exact computer-aided worst-case guarantees on the performance of second-order optimization methods on classes of univariate functions. We first present a generic technique to derive interpolation…

Optimization and Control · Mathematics 2025-07-01 Anne Rubbens , Nizar Bousselmi , Julien M. Hendrickx , François Glineur

Recent advances in fundamental performance limits for power quantities based on Lagrange duality are proving to be a powerful theoretical tool for understanding electromagnetic wave phenomena. To date, however, in any approach seeking to…

We demonstrate a new, nonlinear optical effect of electric currents. First, a steady current is generated by applying a voltage on a doped GaAs crystal. We demonstrate that this current induces second-harmonic generation of a probe laser…

Materials Science · Physics 2015-06-03 Brian A. Ruzicka , Lalani K. Werake , Guowei Xu , Jacob B. Khurgin , E. Ya. Sherman , Judy Z. Wu , Hui Zhao

Second-harmonic generation (SHG) is a quintessential probe of inversion symmetry breaking in condensed matter. While perturbative $\chi^{(2)}$ processes are well-documented, the nonperturbative regime under intense driving remains largely…

Strongly Correlated Electrons · Physics 2026-04-08 Keisuke Kitayama , Masao Ogata

A new development in the antisymmetrization of the first-order nucleon-nucleus elastic microscopic optical potential is presented which systematically includes the many-body character of the nucleus within the two-body scattering operators.…

Nuclear Theory · Physics 2007-05-23 S. P. Weppner
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