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ab initio Computational Chemistry

License: Free ‎File size: N/A
‎Users Rating: 2.5/5 - ‎2 ‎votes

ABOUT ab initio Computational Chemistry

A set of computational chemistry modules and programs to perform ab initio calculations of various properties of small molecules. The system will use GRID technology for large computations. The system will use C++ and Qt, running on Win32 and Linux

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