Related papers: NCrystal : a library for thermal neutron transport
Metallic glasses are promising materials with unique mechanical and thermal properties, but their atomic-scale dynamics remain challenging to understand. In this work, we develop a unified approach to investigate the glass transition and…
We present a coupled atomistic-continuum method for the modeling of defects and interface dynamics of crystalline materials. The method uses atomistic models such as molecular dynamics near defects and interfaces, and continuum models away…
The phase-field-crystal model is used to access the structure and thermodynamics of interfaces between two coexisting liquid crystalline phases in two spatial dimensions. Depending on the model parameters there is a variety of possible…
Supernovae emit large fluxes of neutrinos which can be detected by detectors on Earth. Future tonne-scale detectors will be sensitive to several neutrino interaction channels, with thousands of events expected if a supernova emerges in the…
We have developed an efficient simulation tool 'GOLLUM' for the computation of electrical, spin and thermal transport characteristics of complex nanostructures. The new multi-scale, multi-terminal tool addresses a number of new challenges…
We calculate the correlation functions needed to describe the linear response of superfluid matter, and go on to calculate the differential cross section for neutral-current neutrino scattering in superfluid neutron matter and in…
The fragmentation description is used to analyse calculated neutron scattering intensities from kagom\'e ice and spin ice systems. The longitudinal, transverse and harmonic fragments produce independent contributions to the neutron…
We present a covariant ray tracing algorithm for computing high-resolution neutrino distributions in general relativistic numerical spacetimes with hydrodynamical sources. Our formulation treats the very important effect of elastic…
We introduce kALDo2.0, an open-source Python package for computing vibrational, elastic, and thermal transport properties of solids from first principles and machine-learned interatomic potentials. Building on the anharmonic lattice…
Molecular dynamics is widely used to study various phenomena, such as diffusion, shock wave propagation, and plasma dynamics. A wide range of software packages supports the expanding scope of molecular dynamics applications. However, the…
Nexus-CAT (Cluster Analysis Toolkit) is an open-source Python package for cluster detection and percolation analysis of atomistic simulation trajectories. Standard structural tools, such as the pair distribution function or structure…
Precision tests of the standard model are essential for constraining models of new physics. Neutrino-electron elastic scattering offers a clean probe into many electroweak effects that are complimentary to the more canonical measurements…
This report introduces Juno, a modular Python package for optical design and simulation. Juno consists of a complete library that includes a graphical user interface to design and visualise arbitrary optical elements, set up wave…
The Kassiopeia software package was originally developed to simulate electromagnetic fields and charged particle trajectories for neutrino mass measurement experiments. Recent additions to Kassiopeia also allow it to simulate neutral…
We develop a Python-based open-source package to analyze the results stemming from ab initio molecular-dynamics simulations of fluids. The package is best suited for applications on natural systems, like silicate and oxide melts,…
A systematic study of the sensitivities of simulation input on the computed stress distributions in two-phase microstructures is presented. The study supports a related investigation of the initiation and propagation of yielding in duplex…
The NeXus format allows the storage of measured data next to a description of sample and instrument setup in a standardized manner. The NeXus standard itself gives only general rules how an instrument setup is described. A so called…
$\underline{\textbf{MO}}$nte-carlo $\underline{\textbf{N}}$ucleon transport $\underline{\textbf{C}}$ode (MONC) for nucleon transport is being developed for several years. Constructive Solid Geometry concept is applied with the help of solid…
The microphysics of electron and photon propagation in liquid argon is a key component of detector design and calibrations needed to construct and perform measurements within a wide range of particle physics experiments. As experiments grow…
This study introduces a new Scintillator Simulation Library called SSLG4 for the Geant4 Monte Carlo simulation package. With SSLG4, we aim to enhance efficiency and accelerate progress in optical simulations within the Geant4 framework by…