Showing 2 open source projects for "matlab face code"

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    nwhess2freq

    Calculates frequencies/modes from an nwchem generated hessian

    This is a simple Octave script which calculates the frequencies/normal modes from an nwchem generated hessian matrix. The advantage of having a separate script for this is that you can use the same hessian to calculate frequencies for different isotopic substitutions i.e. you only have to run one nwchem calculation. The script is finished in its current form in the sense that it is feature complete. Feel free to amend, translate, copy, steal etc. See the README in the code repository...
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  • 2
    The purpose of the software is to calculate the undulation between the WGS84 ellipsoid (GPS height) and the EGM96 geoid (mean sea level) in MATLAB, based on the C code in the "egm96-f477.c" project
    Downloads: 0 This Week
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