Found 5 datasets matching filters.
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The NIST Computational Chemistry Comparison and Benchmark Database is a collection of experimental and ab initio thermochemical properties for a selected set of gas-phase molecules. The goals are...
Search relevance: 1.00 | Views last month: 7 | Published on: 2025-08-02 -
The NIST Chemistry WebBook provides users with easy access to chemical and physical property data for chemical species through the internet. The data provided in the site are from collections...
Search relevance: 1.00 | Views last month: 2 | Published on: 2025-08-02 -
Recommended values are provided for chemical thermodynamic properties of inorganic substances and for organic substances usually containing only one or two carbon atoms. Where available, values...
Search relevance: 1.00 | Views last month: 0 | Published on: 2025-08-02 -
Tabulations at 1 K intervals from 1 K to 6000 K of the partition function and standard-state isobaric heat capacity, entropy, and enthalpy for the 12 natural isotopologues of CO2, along with their...
Search relevance: 1.00 | Views last month: 0 | Published on: 2025-08-02 -
Combustion calorimetry is the main method for the determination of enthalpies of formation for organic compounds. Rigorous application of the method uses a 100-step procedure, sometimes called...
Search relevance: 1.00 | Views last month: 0 | Published on: 2025-08-02
