Showing 100 open source projects for "fortran code"

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  • 1
    DL_POLY

    DL_POLY

    General purpose classical molecular dynamics (MD) simulation software

    DL_POLY is a general-purpose classical molecular dynamics simulation package developed at Daresbury Laboratory. It has evolved from older replicated-memory designs into a distributed-memory code suitable for modern parallel computing. The software can be built in serial form or with MPI for larger simulations. It is used for molecular modeling in chemistry, physics, materials science, and condensed-matter research. DL_POLY provides a mature simulation environment for studying atomic and...
    Downloads: 0 This Week
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  • 2
    DifferentialEquations.jl

    DifferentialEquations.jl

    Multi-language suite for high-performance solvers of equations

    ...The well-optimized DifferentialEquations solvers benchmark as some of the fastest implementations, using classic algorithms and ones from recent research which routinely outperform the “standard” C/Fortran methods, and include algorithms optimized for high-precision and HPC applications. At the same time, it wraps the classic C/Fortran methods, making it easy to switch over to them whenever necessary. Solving differential equations with different methods from different languages and packages can be done by changing one line of code, allowing for easy benchmarking to ensure you are using the fastest method possible.
    Downloads: 0 This Week
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  • 3
    OrdinaryDiffEq.jl

    OrdinaryDiffEq.jl

    High performance ordinary differential equation (ODE)

    ...The well-optimized DifferentialEquations solvers benchmark as some of the fastest implementations, using classic algorithms and ones from recent research that routinely outperform the “standard” C/Fortran methods, and include algorithms optimized for high-precision and HPC applications. At the same time, it wraps the classic C/Fortran methods, making it easy to switch over to them whenever necessary. Solving differential equations with different methods from different languages and packages can be done by changing one line of code, allowing for easy benchmarking to ensure you are using the fastest method possible.
    Downloads: 0 This Week
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  • 4
    Elk
    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.
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    Downloads: 111 This Week
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    evTools

    evTools

    Tools to analyse output from the stellar-evolution code ev/STARS/TWIN

    The evTools package provides tools to manipulate and display output from the binary stellar-evolution code ev (also known as STARS and TWIN).
    Downloads: 1 This Week
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  • 6
    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.
    Downloads: 3 This Week
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  • 7
    Computational electromagnetics software. Uses surface Method of Moments, enhanced by using the Multilevel Fast Multipole Method. Code is parallelized and runs on laptops, desktops and clusters. The code precision is adjustable, it is fast and uses little memory. CFIE is used for closed surfaces, and EFIE for open PEC surfaces. Can function on GMSH, GiD and ANSYS meshes.
    Downloads: 4 This Week
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  • 8
    ASALI

    ASALI

    ASALI is an open-source code for chemical engineers

    Do you work with chemical reactors? Are you curious about them? ASALI is the open-source code that you are looking for. Chemical reactor models, transport/thermodynamic properties of gases, equilibrium calculations. ASALI couples all these features with an user friendly graphical interface. Modeling chemical reactors has never been so easy.
    Downloads: 2 This Week
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  • 9
    SWAN
    SWAN is a third-generation wave model, developed at Delft University of Technology, that computes random, short-crested wind-generated waves in coastal regions and inland waters.
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    Downloads: 69 This Week
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  • 10
    librsb

    librsb

    A shared memory parallel sparse matrix library including Sparse BLAS.

    librsb is a library for sparse matrix computations featuring the Recursive Sparse Blocks (RSB) matrix format. This format allows cache efficient and multi-threaded (that is, shared memory parallel) operations on large sparse matrices. The most common operations necessary to iterative solvers are available, e.g.: matrix-vector multiplication, triangular solution, rows/columns scaling, diagonal extraction / setting, blocks extraction, norm computation, formats conversion. The RSB format is...
    Downloads: 70 This Week
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  • 11

    Fosite - advection problem solver

    numerical simulation code for solving transport equations in 1D/2D/3D

    ...The underlying numerical solution method belongs to the family of unsplit conservative finite volume TVD schemes. The method is 2nd order accurate in space and uses high order Runge-Kutta and multistep schemes for time evolution. In addition to the pure advection code several source terms have been implemented including viscous diffusion and gravitational acceleration. Fosite is written with object-oriented patterns in Fortran 2003 and follows the Structure of Arrays (SoA) layout, operating on generic field datatypes. This allows for high performance on modern architectures (SIMD). It is parallelized and vectorized. ...
    Downloads: 0 This Week
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  • 12
    MOSSCO

    MOSSCO

    Modular System for Shelves and Coasts

    The Modular System for Shelves and Coasts (MOSSCO) is a coupling framework for Earth System Models. It helps users to integrate their own numerical models with other developments. Quick Start: git clone git://git.code.sf.net/p/mossco/setups mossco-setups git clone git://git.code.sf.net/p/mossco/code mossco-code cd mossco-code cat QuickStart.md or read online https://sf.net/p/mossco/code/ci/master/tree/QuickStart.md Beware: this is alpha software, expect...
    Downloads: 0 This Week
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  • 13
    Zgoubi is a raytracing code. Since 1972 it pushes charged particles through accelerators and beam lines, by stepwise solution of Lorentz force equation - and their spins via Thomas-BMT differential equation. Zgoubi simulates beam dynamics and polarization in a variety of accelerators (storage ring, synchrotron, cyclotron, betatron, microtron, FFAG, multi-pass ERL, etc) and optical systems (beam lines, magnetic and electrostatic optical components, time-of-flight and mass...
    Downloads: 1 This Week
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  • 14
    TFEL/MFront

    TFEL/MFront

    TFEL/MFront introduces DSLs based on C++ to handle material knowledge

    ...Various performance benchmarks show that the code generated using MFront is in most cases on par or better than other implementations, generally written in Fortran. For mechanical behaviours, MFront introduces interfaces for various finite element or FTT solvers (Cast3M, Code-Aster, ZeBuLoN, Abaqus, Europlexus, AMITEX_FFT, etc..). The authors hope that it will prove usefull for researchers and engineers, in particular in the field of solid mechanics.
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    Downloads: 4 This Week
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  • 15
    SWASH
    SWASH is a general-purpose numerical tool for simulating unsteady, non-hydrostatic, free-surface, rotational flow and transport phenomena in coastal waters as driven by waves, tides, buoyancy and wind forces. It provides a general basis for describing wave transformations from deep water to a beach, port or harbour, complex changes to rapidly varied flows, and density driven flows in coastal seas, estuaries, lakes and rivers.
    Downloads: 6 This Week
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  • 16
    CAMPARI

    CAMPARI

    Software for molecular simulations and trajectory analysis

    We are proud to introduce version 5 of CAMPARI. We have added a number of new features, most notably a Python interface for interpreting user-supplied code (with the help of ForPy), a novel trajectory storage standard (with the help of libpqxx/PostgreSQL), and a module for performing transition path theory. Naturally, CAMPARI continues to provide the reference implementation of the ABSINTH force field paradigm and implicit solvation model. CAMPARI is a joint package for performing and...
    Downloads: 8 This Week
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  • 17
    SolTrack

    SolTrack

    A free, fast and accurate routine to compute the position of the Sun

    ...The code is based on the astronomical Fortran library libTheSky and can be used, modified and distributed under the conditions of version 3 of the GNU Public Licence.
    Downloads: 4 This Week
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  • 18

    ELPA_2022.05.001

    Branch clone of 2022.05.001 version

    The ELPA library provides highly efficient and highly scalable direct eigensolvers for symmetric (hermitian) matrices. Branch clone of the ELPA library, 2022.05.001 version. No changes are introduced, no intention to modify the code. Cloned in case the repository at elpa.mpcdf.mpg.de becomes inaccessible. Developed by Max Planck Computing and Data Facility, LGPL v3 license
    Downloads: 0 This Week
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  • 19
    RINGS "Rigorous Investigation of Networks Generated using Simulations" is a scientific code developed in Fortran90/MPI to analyze the results of molecular dynamics simulations. Its main feature is the analysis of the connectivity using ring statistics.
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    Downloads: 5 This Week
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  • 20
    PUPIL
    PUPIL (Program for User Package Interface and Linking), is a software environment that allows developers to link quickly and efficiently together multiple pieces of software in a fully automated multi-scale simulation. More specifically, it supports QM/MM MD simulations where the user might choose among any of the different MD engines and QM engines, which are connected to PUPIL as external programs through a tiny specific interface. One of the main advantages here is that the user can use...
    Downloads: 3 This Week
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  • 21
    NESSIE is a modern first-principle calculation software that can adequately address the need for ever-higher levels of numerical accuracy and high-performance in large-scale electronic structure simulations, as well as pioneer the fundamental study of quantum many-body effects in a large number of emerging nanomaterials. NESSIE is an electronic structure code that uses a real-space FEM discretization and domain-decomposition (DD) to perform all-electron ground-state DFT and real-time...
    Downloads: 0 This Week
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  • 22
    TPLS

    TPLS

    High Resolution Direct Numerical Simulation (DNS) of Two-Phase Flows

    TPLS is a powerful and efficient 3D Direct Numerical Simulation (DNS) flow solver to simulate multiphase flows at unprecedented detail, speed and accuracy. This flow solver has been developed by Lennon Ó Náraigh (Mathematical Sciences, University College Dublin), Prashant Valluri (Engineering, University of Edinburgh), David Scott, Toni Collis and Iain Bethune (EPCC at the University of Edinburgh) and Peter Spelt (Université de Lyon1, Claude Bernard) under the aegis of several HECToR /...
    Downloads: 0 This Week
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  • 23
    giza

    giza

    A scientific plotting library for C/Fortran built on cairo

    A 2D scientific plotting library built on cairo. Provides uniform output to pdf, ps, png and X-Windows. Written in C with no dependencies (other than cairo) as a direct replacement for PGPLOT.
    Downloads: 0 This Week
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  • 24

    HostDesigner

    General purpose de novo molecular design software

    ...Download includes User's Manual, HostDesigner 4.3 source code (in Fortran), data files, example input, HDViewer executables for MacOS, Linux, and Windows, and mengine source code (in C). HostDesigner was developed and posted by author Dr. Benjamin P Hay
    Downloads: 0 This Week
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  • 25
    mesa
    As of 2020, this project has moved. See https://mesastar.org. Release versions can be found on Zenodo at https://doi.org/10.5281/zenodo.2602941. The code is now hosted on GitHub at https://github.com/MESAHub/mesa. You can find the documentation at https://docs.mesastar.org/.
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    Downloads: 18 This Week
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