GAMESS Geometry Optimisation of Methane with Molecular Orbitals Visualisation
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2 سال پیش
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In this tutorial how to
In this tutorial how to perform simple geometry optimisations with GAMESS is explained in a Windows 11 Pro environment. Molecular orbitals are visualised using wxMacMolPlt.
GAMESS: https://www.msg.chem.iastate.edu/gamess/
wxMacMolPlt: http://brettbode.github.io/wxmacmolplt/
GAMESS: https://www.msg.chem.iastate.edu/gamess/
wxMacMolPlt: http://brettbode.github.io/wxmacmolplt/
2 سال پیش
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