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Computational Chemistry Comparison and Benchmark Database

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Computational Chemistry Comparison and Benchmark Database

Computational Chemistry Comparison and Benchmark Database

This note covers the following topics: Experimental data, Calculated data, Data comparisons, Cost comparisons, Input and output files, Geometries, Vibrations, Reaction data, Entropy data, Bibliographic data, Ion data, Bad calculations, Index of properties and H-bond dimers.

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