Search Results for "gaussian 03"

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Showing 2 open source projects for "gaussian 03"

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    Nancy_EX

    Quantum Chemistry: Excited States Topology

    An open source code for the analysis of electronic excited states: Natural Transition Orbitals; Detachment and Attachment Density Matrices; Quantum Chemical Charge-Transfer Descriptors. The code is intended to postprocess Gaussian 03 and 09 outputs. Important Note: A new release with better compilation option has been released on November the 9th 2015. We strongly advise to use this one since the previous option may have led to some unexpected bugs.
    Downloads: 3 This Week
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  • 2
    g03mem takes a Gaussian 03 input file and gives the computational requirements needed for its execution.
    Downloads: 0 This Week
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