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  2. Joule per mole - Wikipedia

    en.wikipedia.org/wiki/Joule_per_mole

    [1] [2] For example, the Gibbs free energy of a compound in the area of thermochemistry is often quantified in units of kilojoules per mole (symbol: kJ·mol −1 or kJ/mol), with 1 kilojoule = 1000 joules. [3] Physical quantities measured in J·mol −1 usually describe quantities of energy transferred during phase transformations or chemical ...

  3. Thermodynamic databases for pure substances - Wikipedia

    en.wikipedia.org/wiki/Thermodynamic_databases...

    Free Steam Tables Online calculator based on IAPWS-IF97; FACT-Web programs Various on-line tools for obtaining thermodynamic data and making equilibrium calculations. Mol-Instincts A chemical database based on Quantum Mechanics and QSPR, providing thermodynamic properties for millions of compounds.

  4. Molar ionization energies of the elements - Wikipedia

    en.wikipedia.org/wiki/Molar_ionization_energies...

    The Chemistry of the Actinide and Transactinide Elements (3rd ed.). Dordrecht, The Netherlands: Springer Science+Business Media. ISBN 1-4020-3555-1. (for predictions) Cotton, Simon (2006). Lanthanide and Actinide Chemistry. John Wiley & Sons Ltd. Fricke, Burkhard (1975). "Superheavy elements: a prediction of their chemical and physical properties".

  5. List of quantum chemistry and solid-state physics software

    en.wikipedia.org/wiki/List_of_quantum_chemistry...

    Quantum chemistry computer programs are used in computational chemistry to implement the methods of quantum chemistry. Most include the Hartree–Fock (HF) and some post-Hartree–Fock methods. They may also include density functional theory (DFT), molecular mechanics or semi-empirical quantum chemistry methods .

  6. Table of specific heat capacities - Wikipedia

    en.wikipedia.org/wiki/Table_of_specific_heat...

    The contribution of the muscle to the specific heat of the body is approximately 47%, and the contribution of the fat and skin is approximately 24%. The specific heat of tissues range from ~0.7 kJ · kg−1 · °C−1 for tooth (enamel) to 4.2 kJ · kg−1 · °C−1 for eye (sclera). [13]

  7. Computational chemistry - Wikipedia

    en.wikipedia.org/wiki/Computational_chemistry

    Computational chemistry is a branch of chemistry that uses computer simulations to assist in solving chemical problems. [1] It uses methods of theoretical chemistry incorporated into computer programs to calculate the structures and properties of molecules , groups of molecules, and solids. [ 2 ]

  8. KJ Apa Takes Nude Photos of Clara Berry as She Declares ... - AOL

    www.aol.com/entertainment/kj-apa-takes-nude...

    Heating up! KJ Apa and girlfriend Clara Berry hinted that things have gotten serious between them while sharing intimate photos on Instagram. Love Story Beginnings: How Celeb Couples First Met ...

  9. Spartan (chemistry software) - Wikipedia

    en.wikipedia.org/wiki/Spartan_(chemistry_software)

    Spartan is a molecular modelling and computational chemistry application from Wavefunction. [2] It contains code for molecular mechanics, semi-empirical methods, ab initio models, [3] density functional models, [4] post-Hartree–Fock models, [5] thermochemical recipes including G3(MP2) [6] and T1.

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