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相关论文: Automatic physical phasing X-ray crystallography

200 篇论文

Mechanically induced crystallographic phase transformation that reflects dynamic stress responses of intrinsically stochastic nature is a pertinent yet much less well-understood phenomenon. We focus on understanding the physical…

材料科学 · 物理学 2021-09-21 Arijit Maitra , Bipin Singh

We combine the theory of inside-source/inside-detector x-ray fluorescence holography and Kossel lines/x ray standing waves in kinematic approximation to directly obtain the phases of the diffraction structure factors. The influence of…

The analysis of defects and defect dynamics in crystalline materials is important for fundamental science and for a wide range of applied engineering. With increasing system size the analysis of molecular-dynamics simulation data becomes…

计算物理 · 物理学 2020-04-20 U. von Toussaint , F. J. Dominguez-Gutierrez , M. Compostella , M. Rampp

Non-linear photonic crystals can be used to provide phase-matching for frequency conversion in optically isotropic materials. The phase-matching mechanism proposed here is a combination of form birefringence and phase velocity dispersion in…

量子物理 · 物理学 2009-11-10 Michiel J. A. de Dood , William T. M. Irvine , Dirk Bouwmeester

The present state of mathematical diffraction theory for systems with continuous spectral components is reviewed and extended. We begin with a discussion of various characteristic examples with singular or absolutely continuous diffraction,…

数学物理 · 物理学 2015-10-30 Michael Baake , Matthias Birkner , Uwe Grimm

In a physical system, changing parameters such as temperature can induce a phase transition: an abrupt change from one state of matter to another. Analogous phenomena have recently been observed in large language models. Typically, the task…

机器学习 · 计算机科学 2024-05-28 Julian Arnold , Flemming Holtorf , Frank Schäfer , Niels Lörch

Accurate phase measurement is highly desirable in optical manipulation driven by structured light, since the phase profiles have a close connection with optical force distribution, strongly affecting the capability of optical traps. Here,…

光学 · 物理学 2023-01-25 Xionggui Tang , Yanhua Xu , Yi Shen , Wenjing Rong

Recent DFT (density functional theory) simulations showed that metals have a hitherto overlooked symmetry termed "hidden scale invariance" [Hummel {\em et al.}, Phys. Rev. B {\bf{92}}, 174116 (2015)]. According to isomorph theory, this…

材料科学 · 物理学 2019-03-06 Laura Friedeheim , Jeppe C. Dyre , Nicholas P. Bailey

Detection of phase variations across optically transparent samples is often a difficult task. We propose and demonstrate a compact, lightweight and low cost quantitative phase contrast imager. Light diffracted from a pinhole is incident on…

X-ray as well as electron diffraction are powerful tools for structure determination of molecules. Studies on randomly oriented molecules in the gas-phase address cases in which molecular crystals cannot be generated or the interaction-free…

The processes of radiation defects formation and evolution have been simulated in cubic dielectric crystals by the computational method of cellular automata. If suppose that the defects concentration as a parameter, which characterizes a…

元胞自动机与格子气 · 物理学 2011-05-03 K. Baktybekov , Ye. Vertyagina

Phase fractions, compositions and energies of the stable phases as a function of macroscopic composition, temperature, and pressure (X-T-P) are the principle correlations needed for the design of new materials and improvement of existing…

材料科学 · 物理学 2020-02-04 Noah H Paulson , Brandon J Bocklund , Richard A Otis , Zi-Kui Liu , Marius Stan

Spectra of parametric X-ray radiation (PXR) are considered in the range of anomalous dispersion for one of the atoms in a crystal elementary cell. The PXR spectra are calculated both for the ultra-relativistic and non-relativistic electrons…

材料科学 · 物理学 2007-05-23 I. D. Feranchuk , A. P. Ulyanenkov

We present a simplified model for dynamical diffraction of particles through a periodic thick perfect crystal based on repeated application of a coherent beam splitting unitary at coarse-grained lattice sites. By demanding translational…

量子物理 · 物理学 2016-12-14 J. Nsofini , K. Ghofrani , D. Sarenac , D. G. Cory , D. A. Pushin

X-ray diffraction was demonstrated from shock-compressed polycrystalline metal on nanosecond time scales. Laser ablation was used to induce shock waves in polycrystalline foils of Be, 25 to 125 microns thick. A second laser pulse was used…

其他凝聚态物理 · 物理学 2008-01-23 Damian C. Swift

The field of topological photonics emerged as one of the most promising areas for applications in transformative technologies: possible applications are in topological lasers or quantum optics interfaces. Nevertheless, efficient and simple…

The variety of the phase transitions in Induced QCD are studied. Depending upon the parameters in the scalar field potential, there could be infinite number of fixed points, with different critical behavior. The integral equation for the…

高能物理 - 格点 · 物理学 2015-06-25 A. A. Migdal

A unified theory of phase transitions and quantum effects in quantum anharmonic crystals is presented. In its framework, the relationship between these two phenomena is analyzed. The theory is based on the representation of the model Gibbs…

数学物理 · 物理学 2009-11-13 Alina Kargol , Yuri Kondratiev , Yuri Kozitsky

It was recently shown that the phase retrieval imaging of a sample can be modeled as a simple convolution process. Sometimes, such a convolution depends on physical parameters of the sample which are difficult to estimate a priori. In this…

Kinematic diffraction is well suited for a mathematical approach via measures, which has substantially been developed since the discovery of quasicrystals. The need for further insight emerged from the question of which distributions of…

材料科学 · 物理学 2019-07-17 Michael Baake , Uwe Grimm