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This study presents a preliminary design and simulation of a thermal neutron diffractometer using the McStas Monte Carlo ray-tracing package. The simulated system is based on generalized instrument parameters, including typical collimator…

Instrumentation and Detectors · Physics 2025-05-06 Li-Fang Chen

In this work we present the development of small angle scattering components in McStas that describe the neutron interaction with 70 different form and structure factors. We describe the considerations taken into account for the generation…

Instrumentation and Detectors · Physics 2025-01-13 Jose Robledo , Klaus Lieutenant , Peter Willendrup

McStas and Mantid are two well established software frameworks within the neutron scattering community. McStas has been primarily used for simulating the neutron transport of instruments, while Mantid has been primarily used for data…

Instrumentation and Detectors · Physics 2016-08-26 Torben R Nielsen , Anders J Markvardsen , Peter K Willendrup

We present an overview of, and an introduction to, the general-purpose neutron simulation package McStas. We present the basic principles behind Monte Carlo ray-tracing simulations of neutrons performed in the package and present a few…

Instrumentation and Detectors · Physics 2020-10-02 P. K. Willendrup , K. Lefmann

The NCrystal library provides a range of models for simulation of both elastic and inelastic scattering of thermal neutrons in a range of material structures. This article presents the available models for elastic scattering, and includes…

Computational Physics · Physics 2021-07-28 Thomas Kittelmann , Xiao-Xiao Cai

An open source software package for modelling thermal neutron transport is presented. The code facilitates Monte Carlo-based transport simulations and focuses in the initial release on interactions in both mosaic single crystals as well as…

Computational Physics · Physics 2019-11-06 Xiao-Xiao Cai , Thomas Kittelmann

An open source software package for simulating thermal neutron propagation in geometry is presented. In this system, neutron propagation can be treated by either the particle transport method or the ray-tracing method. Supported by an…

Computational Physics · Physics 2023-12-05 Zi-Yi Pan , Ni Yang , Ming Tang , Peixun Shen , Xiao-Xiao Cai

The investigation of light-induced structural changes by diffractive methods has improved much in the last two decades. We present here the case of neutron photocrystallography for which we have built a special experimental setup at the…

Materials Science · Physics 2008-07-21 J. Schefer , D. Schaniel , V. Petricek , Th. Woike

The recent development of a micromagnetic simulation methodology - suitable for multiphase magnetic nanocomposites - permits the computation of the magnetic microstructure and of the associated magnetic small-angle neutron scattering (SANS)…

Mesoscale and Nanoscale Physics · Physics 2012-07-11 Andreas Michels , Sergey Erokhin , Dmitry Berkov , Nataliya Gorn

Using the Monte Carlo ray tracing package McStas, we illustrate the possibilities of creating virtual experiments of the neutron spectrometer BIFROST at the European Spallation Source, ESS. With this model, we are able to benchmark BIFROST…

Instrumentation and Detectors · Physics 2025-12-24 Kristine M. L. Krighaar , Silas B. Schack , Nicolai L. Amin , Gregory S. Tucker , Rasmus Toft-Petersen , Kim Lefmann

Neutron imaging has gained significant importance as a material characterisation technique and is particularly useful to visualise hydrogenous materials in objects opaque to other radiations. Particular fields of application include…

Materials Science · Physics 2026-01-14 Estrid Buhl Naver , Okan Yetik , Noémie Ott , Matteo Busi , Pavel Trtik , Luise Theil Kuhn , Markus Strobl

We have used numerical micromagnetics for the calculation of the magnetic (small-angle) neutron scattering cross section of nanocomposites. The novel aspect of our approach consists in the possibility to study the applied-field dependence…

Mesoscale and Nanoscale Physics · Physics 2015-06-03 S. Erokhin , D. Berkov , N. Gorn , A. Michels

We introduce a computer program to simulate the results of neutron powder-diffraction experiments at the High Flux Isotope Reactor at Oak Ridge National Laboratory. The program is freely available as a web application at…

Nanocomposites enable us to tune parameters that are crucial for use of such materials for neutron-optics applications such as diffraction gratings by careful choice of properties such as species (isotope) and concentration of contained…

Machine learning has emerged as a powerful tool in materials discovery, enabling the rapid design of novel materials with tailored properties for countless applications, including in the context of energy and sustainability. To ensure the…

Computational tools for normal mode analysis, which are widely used in physics and materials science problems, are designed here in a single package called NMscatt (Normal Modes & scattering) that allows arbitrarily large systems to be…

Computational Physics · Physics 2009-11-13 Franci Merzel , Fabien Fontaine-Vive , Mark R. Johnson

The magnetic structure of BaFe2As2 was completely determined from polycrystalline neutron diffraction measurements soon after the ThCr2Si2-type FeAs-based superconductors were discovered. Both the moment direction and the in-plane…

Superconductivity · Physics 2009-05-08 M. Kofu , Y. Qiu , Wei Bao , S. -H. Lee , S. Chang , T. Wu , G. Wu , X. H. Chen

Neutron oscillation into mirror neutron, a sterile state exactly degenerate in mass with the neutron, could be a very rapid process, even faster than the neutron decay itself. It can be observed by comparing the neutron lose rates in an…

Computational Physics · Physics 2018-09-05 Riccardo Biondi

Numerical relativity simulations are essential to study the last stages of the binary neutron star coalescence. Unfortunately, for stable simulations there is the need to add an artificial low-density atmosphere. Here we discuss a new…

General Relativity and Quantum Cosmology · Physics 2020-11-11 Amit Poudel , Wolfgang Tichy , Bernd Brügmann , Tim Dietrich

As the trend of neutron guide designs points towards longer and more complex guides, imperfections such as waviness becomes increasingly important. Simulations of guide waviness has so far been limited by a lack of reasonable waviness…

Instrumentation and Detectors · Physics 2016-12-13 Ursula Bengaard Hansen , Mads Bertelsen , Erik Bergbäck Knudsen , Kim Lefmann
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