Computational Chemistry Comparison and Benchmark Database - Database of molecules with well established heat of formation, no atoms with atomic number greater t

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Computational Chemistry Comparison and Benchmark Database

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	Database of molecules with well established heat of formation, no atoms with atomic number greater than 17 (Chlorine,) and six or fewer heavy atoms and twenty or fewer total atoms. Sponsored Links:
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Title:	CCCBDB Computational Chemistry Comparison and Benchmark Database
Description:	Ideal-gas thermochemistry. Comparisons between theory and experiment.
Category:	Computational - Moment - Heat - Factor - Chemistry - Length - Atomic - Bond - Molecular - Vibrational - Formation - Enthalpy - Entropy - Dipole - Charges - Scaling - Frequencies - Thermochemistry - Initio - Geometries - Polarizability

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