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The Computational Chemistry Comparison and Benchmark Database (CCCBDB) contains links to experimental and computational thermochemical data for a selected set ...
atomic charges  bond angles  bond length  molecular geometries  vibrational scaling factor 
www.accyflor.com - 2009-04-02
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Vibrational Living offers breakthrough solutions for optimizing health, wellness and balance using the universal principles of quantum physics, vibrational ...
vibrational frequency products 
www.vibrationalliving.com - 2009-02-07
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Parallel Quantum Solutions, atomic structure calculation, parallel quantum calculation, parallel computing, molecular modeling, molecular modelling, abinitio, ...
pqs-chem.com - 2009-02-08
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