Datasets associated with articles published in Computer Physics Communications

openPSTD: the open source pseudospectral timedomain method for acoustic propagation
An open source implementation of the Fourier pseudospectral timedomain (PSTD) method for computing the propagation of sound is presented, which is geared towards applications in the built environment. Being a wavebased method, PSTD captures phenomena like in… 
TAUOLA of tau lepton decays—framework for hadronic currents, matrix elements and anomalous decays
This paper presents an update of the Monte Carlo event generator TAUOLA for tau lepton decays, with substantially increased list of decay channels and new initialization options. The core of the program is still written in FORTRAN, but necessary arrangements a… 
BREMS: A program for calculating spectra and angular distributions of bremsstrahlung at electron energies less than 3 MeV
This work describes a program that implements the method developed by Tseng and Pratt in the 1970s for exact screened calculations of atomicfield bremsstrahlung. The calculation method is based on the relativistic partialwave formulation describing of the an… 
PUFoam: a novel opensource CFD solver for the simulation of expanding and reacting polyurethane foams
In this work a transient threedimensional mathematical model is formulated and validated for the simulation of polyurethane (PU) foams. The model is based on computational fluid dynamics (CFD) and is coupled with a population balance equation (PBE) to the of… 
New version of FDTD with GFM program in Schwarzschild spacetime
Finite difference time domain (FDTD) method in curved space–time is developed by filling the flat space–time with an equivalent medium. Green function Method (GFM) in curved space–time is solving transport equations. This is a new version of FDTD and GFM in so… 
GR@PPA 2.9: Radiation matching for simulating photon production processes in hadron collisions
We release an event generator package GR@PPA 2.9, for simulating the direct (single) photon and diphoton (double photon) production in hadron collisions. The included programs were used in our previous studies, in which we have explicitly shown large from The… 
CCOMP: An efficient algorithm for complex roots computation of determinantal equations
In this paper a free Python algorithm, entitled CCOMP (Complex roots COMPutation), is developed for the efficient computation of complex roots of determinantal equations inside a prescribed complex domain. The key to the method presented is the efficient of in… 
BASDet: Bayesian Approach(es) for Structure Determination from Single Molecule Xray Diffraction Images
Xray free electron lasers (XFEL) are expected to enable molecular structure determination in single molecule diffraction experiments. In this paper, we describe an implementation of two orthogonal Bayesian approaches, previously introduced in Walczak and of a… 
Quantum lattice model solver HΦ
HΦ [aitchphi] is a program package based on the Lanczostype eigenvalue solution applicable to a broad range of quantum lattice models, i.e., arbitrary quantum lattice models with twobody interactions, including the Heisenberg model, the Kitaev model, the it… 
OpenMP, OpenMP/MPI, and CUDA/MPI C programs for solving the timedependent dipolar GrossPitaevskii equation
We present new versions of the previously published C and CUDA programs for solving the dipolar Gross–Pitaevskii equation in one, two, and three spatial dimensions, which calculate stationary and nonstationary solutions by propagation in imaginary or real are…