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Given the widespread use of density functional theory (DFT), there is an increasing need for the ability to model large systems (beyond 1,000 atoms). We present a brief overview of the large-scale DFT code Conquest, which is capable of…

We present an accurate, efficient and massively parallel finite-element code, DFT-FE, for large-scale ab-initio calculations (reaching $\sim 100,000$ electrons) using Kohn-Sham density functional theory (DFT). DFT-FE is based on a local…

Computational Physics · Physics 2020-01-08 Phani Motamarri , Sambit Das , Shiva Rudraraju , Krishnendu Ghosh , Denis Davydov , Vikram Gavini

In TDD massive MIMO systems, channel estimation under sparse frequency-hopping pilots is challenging: each snapshot captures only one narrow pilot block that hops across frequency, with tens of milliseconds between adjacent snapshots.…

Signal Processing · Electrical Eng. & Systems 2026-04-08 Yufei Ma , Xu Zhu , Tiejun Li

This paper presents a novel physically consistent analytical model for two-dimensional (2D) waveguide-fed metasurface antennas that is based on the discrete dipole approximation. The proposed framework extends previous works deriving…

Signal Processing · Electrical Eng. & Systems 2026-05-06 Panagiotis Gavriilidis , George C. Alexandropoulos

The dispersion and dissipation properties of a scheme are important to realize high-fidelity simulations of the compressible flow, especially the cases with broadband length scales. It has been recognized that the minimization of dispersion…

Fluid Dynamics · Physics 2021-10-28 Y. T. Su , Y. H. Li , Y. X. Ren

Optical metasurfaces are planar substrates with custom-designed, nanoscale features that selectively modulate incident light with respect to direction, wavelength, and polarization. When coupled with photodetectors and appropriate…

We formulate a finite-difference time-domain (FDTD) approach to simulate electromagnetic wave scattering from scatterers embedded in layered dielectric or dispersive media. At the heart of our approach is a derivation of an equivalent…

Mesoscale and Nanoscale Physics · Physics 2015-05-18 Lingxiao Zhang , Tamar Seideman

Plastic scintillation detectors are increasingly used to measure dose distributions in the context of radiotherapy treatments. Their water-equivalence, real-time response and high spatial resolution distinguish them from traditional…

Medical Physics · Physics 2021-09-22 Emily Cloutier , Louis Archambault , Luc Beaulieu

Single-shot coherent diffractive imaging (CDI) using intense XUV and soft X-ray pulses holds the promise to deliver information on the three dimensional shape as well as the optical properties of nano-scale objects in a single diffraction…

Optics · Physics 2025-11-25 Paul Tuemmler , Julia Apportin , Thomas Fennel , Christian Peltz

Anomaly detection in complex, high-dimensional data, such as UAV sensor readings, is essential for operational safety but challenging for existing methods due to their limited sensitivity, scalability, and inability to capture intricate…

Machine Learning · Computer Science 2025-10-28 Mingze Gong , Juan Du , Jianbang You

As the search space for light dark matter (DM) has shifted to sub-GeV DM candidate particles, increasing attention has turned to solid state detectors built from quantum materials. While traditional solid state detector targets (e.g. Si or…

High Energy Physics - Phenomenology · Physics 2023-10-04 Elizabeth A. Peterson , Samuel L. Watkins , Christopher Lane , Jian-Xin Zhu

We consider the numerical approximation of the radiative transfer equation using discontinuous angular and continuous spatial approximations for the even parts of the solution. The even-parity equations are solved using a diffusion…

Numerical Analysis · Mathematics 2019-09-19 Olena Palii , Matthias Schlottbom

We present a corrective subcell averaging technique that improves on the accuracy of the volume-averaged finite-difference time-domain (FDTD) method in the presence of dispersive material interfaces. The method is based on an alternative…

Computational Physics · Physics 2015-06-15 Joachim Hamm , Fabian Renn , Ortwin Hess

Particle size measurement is crucial in various applications, be it sizing droplets in inkjet printing or respiratory events, tracking particulate ejection in hypersonic impacts, or detecting floating target markers in free surface flows.…

Fluid Dynamics · Physics 2023-10-04 Saini Jatin Rao , Shubham Sharma , Saptarshi Basu , Cameron Tropea

We have developed a nonlinear differential effective dipole approximation (NDEDA), in an attempt to investigate the effective linear and third-order nonlinear susceptibility of composite media in which graded spherical inclusions with weak…

Materials Science · Physics 2007-05-23 L. Gao , J. P. Huang , K. W. Yu

Interferometric Particle Imaging (IPI) is a powerful technique to characterize aerosol particles, which so far has been applied only to particles larger than about 100 wavelengths. We extend its applicability to smaller ice crystals,…

Optics · Physics 2026-03-24 Marc Brunel , Gilles Demange , Renaud Patte , Maxim Yurkin

We present an open-source program free to download for academic use with full user-friendly graphical interface for performing flexible and robust background subtraction and dipole fitting on magnetization data. For magnetic samples with…

Data Analysis, Statistics and Probability · Physics 2020-02-07 Matthew J. Coak , Cheng Liu , David M. Jarvis , Seunghyun Park , Matthew J. Cliffe , Paul A. Goddard

Dynamic metasurface antennas (DMAs) are emerging as a promising technology to enable energy-efficient, large array-based multi-antenna systems. This paper presents a simple channel estimation scheme for the downlink of a multiple-input…

Signal Processing · Electrical Eng. & Systems 2026-03-17 Amarilton L. Magalhães , Fazal E-Asim , André L. F. de Almeida , A. Lee Swindlehurst

Predictions for deep Virtual Compton Scattering are obtained in a two-component dipole model of diffraction. The model automatically includes hard and soft components and implicitly allows for ``hadronic'' contributions via large dipoles.…

High Energy Physics - Phenomenology · Physics 2008-11-26 A Donnachie , H G Dosch

In this paper, we propose an efficient implementation of combining Dynamical Mean field theory (DMFT) with electronic structure calculation based on the local density approximation (LDA). The pseudo-potential-plane-wave method is used in…

Strongly Correlated Electrons · Physics 2015-06-03 Jian-Zhou Zhao , Jia-Ning Zhuang , Xiao-Yu Deng , Yan Bi , Ling-Cang Cai , Zhong Fang , Xi Dai