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Extensible Computational Chemistry Environment Basis Set Database, Version 8/01/01, as developed and distributed by the Molecular Science Computing Facility, Environmental and Molecular Sciences Laboratory which is part of the Pacific Northwest Laboratory.
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Science, Chemistry, Physical, Databases - EMSL Gaussian Basis Sets. Extensible Computational Chemistry Environment Basis Set Database, Version 8/01/01, as developed and distributed by the Molecular Science Computing Facility, Environmental and Molecular Sciences Laboratory which is part of the Pacific Northwest Laboratory. |
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JPL Molecular Spectroscopy (Popularity: ): Database which has an extensive library including programs for fitting spectra and spectral line files for a large number of ...
Fundamental Physical Constants from NIST (Popularity: ): The values of the fundamental physical constants provided at this site are recommended for international use by CODATA and are ...
National Institute of Standards and Technology WebBook (Popularity: ): Thermochemical data for over 6000 organic and small inorganic compounds. Reaction thermochemistry data for over 9000 reactions. IR spectra for ...
GRI-Mech (Popularity: ): site at Berkeley also has selected kinetic rate constants and parameters for reactions involving the species included in their database.
Naval Research Laboratory Electronic Structure Calculations Database (Popularity: ): Band structure, total energy, density of states, and derived quantities for most Periodic elements, hydrides, carbides, nitrides, and oxides.
The Radiation Chemistry Data Center of the Notre Dame Radiation Laboratory (Popularity: ): Chemical property data (such as reaction rate constants, and redox potentials,) historic bibliographic information from the RCDC bibliographic database, and ...
NIST Physical Reference Data (Popularity: ): Database holding information on fundamental physical constants, atomic spectra, molecular spectroscopic data, ionization data, X-Ray and Gamma-Ray data, radiation dosimetry ...
Quest Consultants (Popularity: ): Source of thermodynamic data useful in handling phase transitions. The data are given as a function of temperature and pressure ...
University of Alberta (Popularity: ): Tables of chemical data for Fundamental Physical Constants, Relative Atomic Masses of the Chemical Elements, Molar Thermodynamic Properties of Pure ...
Materials Thermochemistry (Middlesex, UK) (Popularity: ): Provides thermodynamic databases, data assessment, and consulting services to companies working with a variety of commercial and industrial materials. Information ...
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National Institute of Standards and Technology WebBook (Popularity: ): Thermochemical data for over 6000 organic and small inorganic compounds. Reaction thermochemistry data for over 9000 reactions. IR spectra for ...
Quantum Chemistry Literature DataBase (Popularity: ): A literature database on ab initio MO calculations published in major journals of Chemistry, Physics and Computer Science since 1978.
Materials Thermochemistry (Middlesex, UK) (Popularity: ): Provides thermodynamic databases, data assessment, and consulting services to companies working with a variety of commercial and industrial materials. Information ...
GRI-Mech (Popularity: ): site at Berkeley also has selected kinetic rate constants and parameters for reactions involving the species included in their database.
NIST Physical Reference Data (Popularity: ): Database holding information on fundamental physical constants, atomic spectra, molecular spectroscopic data, ionization data, X-Ray and Gamma-Ray data, radiation dosimetry ...
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