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Development of new data assimilation techniques for ocean models4 weekly downloads
A tool for performing Quantum Chemistry calculations
Molecular Dynamics Cell Construction49 weekly downloads
Unit testing framework for Fortran with MPI extensions27 weekly downloads
Massively parallel software for quantum chemistry calculations24 weekly downloads
A shared memory parallel sparse matrix library including Sparse BLAS.13 weekly downloads
Fortran codes for SCNURS method - Side Cut Non-Uniform Residual Stress
Towhee is a Monte Carlo molecular simulation code originally designed for the prediction of fluid phase equilibria using atom-based force fields and the Gibbs ensemble with particular attention paid to algorithms addressing molecule conformation sampling.16 weekly downloads
DISCUS is a set of programs to simulate the atomic structure of disordered materials and calculate experimental properties such as diffuse scattering or the atomic pair distribution function.9 weekly downloads
Performance Timing Tools
A spectral element method for 2D wave propagation and fracture dynamics, with emphasis on computational seismology and earthquake source dynamics.7 weekly downloads
Physical software, solves (3+1)D nonlinear parabolic equations. It simulates light propagation throw a continuous medium with saturable gain and absorption.1 weekly downloads
1-dimensional Eulerian Vlasov-Maxwell solver, used primarily for studies of kinetic effects in plasma waves and for stimulated Raman scattering.
An all-electron full-potential linearised augmented-planewave (FP-LAPW) code. Designed to be as developer friendly as possible so that new developments in the field of density functional theory (DFT) can be added quickly and reliably.53 weekly downloads
elsimp is a very simple but efficient and accurate finite element solver for 1-d,2-d,3-d elements. elsimp is written in eiffel language calling c and fortran routines for mathematical calculations.
Interpretation of Biomolecular MD simulations7 weekly downloads
The SAWES (Self-Adapting Wavelet Electronic Structure) code performs density functional theory calculations using wavelet basis sets evolved concurrently with the self-consistent field iterations to optimally represent each wavefunction.
RAMSES is a general purpose simulation code for self-gravitating fluid dynamics with adaptive mesh refinement.
CFDtools is a set of libraries to manage data format for CFD (mesh/grid and flow data). It provides additional tools for development of simulations softwares.
A High-Order Multi-Variate Approximation Scheme for Arbitrary Data Sets, C implementation of the method described in http://web.mit.edu/qiqi/www/paper/interpolation.pdf, with Python and Fortran interfaces.1 weekly downloads
A 2D Eulerian hydro code using Godunov method. Author Ed Dendy.
Gauss-Kronrod quadrature on several variables.
Advanced numerical instruments: adaptive meshing, FE methods, solvers9 weekly downloads
FE simulation based automatic global optimisation in modern Fortran2 weekly downloads
Software for electromagnetic simulation134 weekly downloads