Five software i.e. AMDKIIT , ANN-CI, LITESOPH, MTASpec, and µ2mech are developed as an outcome of the Materials and Computational Chemistry (MSCC) project under the National Supercomputing Mission (NSM). These are the set of codes (software) developed by the investigators to perform the computations to study the properties of atoms, molecules, clusters, alloys, bio-molecules, and composite materials using high-performance computing (HPC).

For more information on the softwares developed under MSCC please go to: https://sourceforge.net/p/mscc-applications-nsm/wiki/

To download the versions of the MSCC softwares installed on NSM HPC systems please go to: https://github.com/mscc07/mscc

To download the test input dataset please go to: https://github.com/mscc07/mscc-testinput

For training material please go to: http://www.youtube.com/@mscctraining

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Molecular Science, Chemistry

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2024-02-16
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