Showing 54 open source projects for "calculation"

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  • 1
    Ion Beam Simulator
    Library for ion optics, plasma extraction and space charge dominated ion beam transport.
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    Downloads: 15 This Week
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  • 2
    schur

    schur

    Interactive Program For Calculating Properties Of Symmetric Functions

    Schur is a standalone program for interactively calculating properties of Lie groups and symmetric functions. Schur has been designed to answer questions of relevance to a wide range of problems of interest to chemists, mathematicians, computer scientists,...
    Downloads: 3 This Week
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  • 3
    xrayutilities

    xrayutilities

    a package with useful scripts for X-ray diffraction physicists

    xrayutilities is a python package used to analyze x-ray diffraction data. It can support with performing diffraction experiments and used for common steps in the data analysis. It can read experimental data from several data formats (spec, edf, xrdml, ...); convert them to reciprocal space for arbitrary goniometer geometries and different detector systems (point, linear as well as area detectors); for further processing the data can be gridded (transformed to a regular grid). More...
    Downloads: 40 This Week
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  • 4
    dotScope

    dotScope

    Scientific shell for live experiment

    ...Pluggable system: different ADC, conversion data in real time, postprocessing editor. Release 2.5: Store data to files, Several desktops, Complete version of postprocessing modules (Calculation, Linearization, Spline, Line regression, Statistic - mean and RMSD, Spectrum analyzer), Output table data for series experiments
    Downloads: 1 This Week
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  • 5
    ransfoil

    ransfoil

    console to calculate airflow around an airfoil based on RANS approach

    ...In addition, the coupling between airflow and heat transfer and the effect of surface roughness on near wall flow are considered by this program, it can be used for engineering calculation of the friction drag and heat transfer coefficients on airfoil surface. RANSFOIL reads coordinates data from a 1D XYZ file which describes the grid points or control points on airfoil as only input, then outputs grid and solution files in 2D PLOT3D format to record grid coordinates and airflow data and a report file to show aerodynamic parameters.
    Downloads: 0 This Week
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  • 6
    ALAMODE

    ALAMODE

    Ab initio simulator for thermal transport and lattice anharmonicity

    ALAMODE is designed for analyzing lattice anharmonicity and lattice thermal conductivity of solids. By using an external DFT package such as VASP and Quantum ESPRESSO, you can extract harmonic and anharmonic force constants straightforwardly with ALAMODE. Using the anharmonic force constants, you can also calculate lattice thermal conductivity from first principles. For more information about ALAMODE, please visit the following webpages: Documentation :...
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    Downloads: 2 This Week
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  • 7
    GSvit

    GSvit

    Fast FDTD solver with graphics card support

    Fast FDTD solver with graphics card support. Optimized for nanoscale optics - scanning near field optical microscopy, rough surface scattering and solar cells. Uses CUDA environment for graphics card operation.
    Downloads: 3 This Week
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  • 8

    Liquid rocket engine parameter solver

    This is the liquid rocket engine parameter solver Alpha release 1.

    This is the liquid rocket engine parameter solver Alpha release 1 which is the first version for this project. This first version will help to find thrust values by giving some values to the system
    Downloads: 0 This Week
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  • 9
    Jljp

    Jljp

    Calculates the voltage across a liquid junction between two solutions

    ...It's a tool for scientists and engineers who have to do with electrochemistry and electrokinetics. When two solutions containing ions are put into contact, possibly through a porous diaphragm, a voltage develops across them. The calculation of the voltage is not trivial. The program is written in Java. Includes classes that can be included in other programs, together with graphical interfaces (also as an applet).
    Downloads: 0 This Week
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  • 10

    SidClock

    *nix Sidereal Clock

    *nix Sidereal Clock Application
    Downloads: 0 This Week
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  • 11
    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 excited-state TDDFT calculations. ...
    Downloads: 0 This Week
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  • 12
    Gabedit is a Graphical User Interface for FireFly (PC-Gamess), Gamess-US, Gaussian, Molcas, Molpro, MPQC, NWChem, OpenMopac, Orca, PSI4 and Q-Chem computational chemistry packages.
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    Downloads: 215 This Week
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  • 13

    Takin

    Inelastic neutron scattering suite.

    The main development repository can be found here: https://code.ill.fr/scientific-software/takin
    Downloads: 0 This Week
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  • 14
    QMForge reads output from various quantum mechanical calculations and provides tools for analyzing these results. Specifically, population (Mulliken and C-squared), fragment, and charge decomposition analyses are available. See https://qmforge.net for more info.
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    Downloads: 1 This Week
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  • 15
    KoBra
    This is a standalone program for a) the calculation of diffusion coefficients of sorbates inside nanoporous materials at different loadings by using transition rate constants and for b) solving the master equation for a system consisted of a large number of unit cells per each direction. It is based on the following published paper "Kolokathis, P. D., Braun, O. M.. J. Comput.
    Downloads: 1 This Week
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  • 16
    JPIV

    JPIV

    Particle Image Velocimetry

    JPIV is a platform independent, graphical stand-alone application for Particle Image Velocimetry (PIV) written in Java. PIV is an optical technique for measuring fluid flow velocities. JPIV moved to GitHub. Please visit us at: https://eguvep.github.io/jpiv/
    Downloads: 0 This Week
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  • 17
    This is an implementation of post-process phonon analyzer, which calculates crystal phonon properties from input information calculated by external codes, e.g., first-principles calculation code.
    Downloads: 5 This Week
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  • 18

    LER&LWR Calculator

    Tool for line edge parameters calculation

    Load a folder with images from raster electron microscope, choose necessary options and let the algorythm calculate the characteristics of the line.
    Downloads: 2 This Week
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  • 19
    datasw

    datasw

    datasw, a tool for rapid processing of HPLC-SAXS data.

    Small-angle X-ray scattering (SAXS) in solution is a common low-resolution method which can efficiently complement high-resolution information obtained by crystallography or NMR. Sample monodispersity is key to reliable SAXS data interpretation and model building. Beamline setups with inline high-performance liquid chromatography (HPLC) are particularly useful for accurate profiling of heterogeneous samples. The program DATASW performs averaging of individual data frames from HPLC-SAXS...
    Downloads: 1 This Week
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  • 20

    DMRG_QC

    DMRG code for Quantum-Chemistry Hamiltonians

    DMRG code for Quantum-Chemistry Hamiltonians, including also the calculation of dynamics response.
    Downloads: 0 This Week
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  • 21
    Calculation of radiation view factors by adaptive integration. A cross-platform port of the public-domain code by George Walton.
    Downloads: 5 This Week
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  • 22
    ThiMeT

    ThiMeT

    Thickness Measurement Tool for SRIM

    ThiMeT v1.0 Thickness Measurement Tool for SRIM ThiMeT is a code for thickness calculation using SRIM (www.srim.org) stopping power values. ThiMeT code also can be used for the determination of the required thickness for energy degraders which are needed for nuclear reactions. ThiMeT calculation is very easy and quick compared to the TRIM code calculation. Please cite ThiMeT code as C. YALÇIN, “Thickness measurement using alpha spectroscopy and SRIM”, J. ...
    Downloads: 2 This Week
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  • 23
    tranci

    tranci

    Calculate electronic properties of transition metal atoms

    Computational package to study transition metal atoms in surfaces, focusing on the effects of crystal field, spin orbit coupling and electronic interactions. Inputs are written in an user friendly interface, and creates a pdf and graphics with the results.
    Downloads: 0 This Week
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  • 24

    Pi-Space Physics Software

    A Physics Theory for Unifying Classical, Quantum and Relativistic Phys

    This is the Official Software of the Pi-Space Physics Theory created by Martin Brady. I have a B.Sc. in Computer Applications from Dublin City University and I have an interest in software implementation of Physics. The Theory includes a Quantum Theory of Gravity as well as a reworking of Classical versions of Newton's Formulas. The Theory is based on a set of Relativistic Diagrams called Pi-Space Diagrams for those new to the Theory. License :: Creative Commons Attribution...
    Downloads: 0 This Week
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  • 25
    SciEnPlot

    SciEnPlot

    Data Plotting and Analysis for Science and Engineering

    ... - Implemented a 3d surface plot (GLSurface) based on OpenGL (ScienPlot v1.3.2 and above) - ColorMap surface, trisurface, Pie, Polar plots, and 3D height field, 3dBar, scatter plots (under developing), and more - Column by column plotting/calculation - LaTex commands enclosed by $ symbols can be used for the labels in Graph - Accept txt(Text) and csv(Comma separated values) formatted data - Save, copy, print Graph - Use spread sheets to display data - Textboard to organize the results - Graphs in a publishable quality - Source codes based on: Python Numpy Scipy Matplotlib WxPython Visvis etc...
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    Downloads: 0 This Week
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