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  2. Acid dissociation constant - Wikipedia

    en.wikipedia.org/wiki/Acid_dissociation_constant

    The dependence on m correlates with the oxidation state of the central atom, X: the higher the oxidation state the stronger the oxyacid. For example, p K a for HClO is 7.2, for HClO 2 is 2.0, for HClO 3 is −1 and HClO 4 is a strong acid ( p K a ≪ 0 ). [ 7 ]

  3. Arrhenius equation - Wikipedia

    en.wikipedia.org/wiki/Arrhenius_equation

    In physical chemistry, the Arrhenius equation is a formula for the temperature dependence of reaction rates.The equation was proposed by Svante Arrhenius in 1889, based on the work of Dutch chemist Jacobus Henricus van 't Hoff who had noted in 1884 that the Van 't Hoff equation for the temperature dependence of equilibrium constants suggests such a formula for the rates of both forward and ...

  4. Van 't Hoff equation - Wikipedia

    en.wikipedia.org/wiki/Van_'t_Hoff_equation

    The Van 't Hoff isotherm can be used to determine the temperature dependence of the Gibbs free energy of reaction for non-standard state reactions at a constant temperature: [6] ( d G d ξ ) T , p = Δ r G = Δ r G ⊖ + R T ln ⁡ Q r , {\displaystyle \left({\frac {dG}{d\xi }}\right)_{T,p}=\Delta _{\mathrm {r} }G=\Delta _{\mathrm {r} }G ...

  5. Dissociation constant - Wikipedia

    en.wikipedia.org/wiki/Dissociation_constant

    In chemistry, biochemistry, and pharmacology, a dissociation constant (K D) is a specific type of equilibrium constant that measures the propensity of a larger object to separate (dissociate) reversibly into smaller components, as when a complex falls apart into its component molecules, or when a salt splits up into its component ions.

  6. Protein pKa calculations - Wikipedia

    en.wikipedia.org/wiki/Protein_pKa_calculations

    The pH-dependence of the activity displayed by enzymes and the pH-dependence of protein stability, for example, are properties that are determined by the pK a values of amino acid side chains. The p K a values of an amino acid side chain in solution is typically inferred from the p K a values of model compounds (compounds that are similar to ...

  7. Free-energy perturbation - Wikipedia

    en.wikipedia.org/wiki/Free-energy_perturbation

    Free-energy perturbation (FEP) is a method based on statistical mechanics that is used in computational chemistry for computing free-energy differences from molecular dynamics or Metropolis Monte Carlo simulations. The FEP method was introduced by Robert W. Zwanzig in 1954. [1]

  8. Equilibrium constant - Wikipedia

    en.wikipedia.org/wiki/Equilibrium_constant

    To evaluate the integrals in this equation, the form of the dependence of heat capacity on temperature needs to be known. If the standard molar heat capacity C o p can be approximated by some analytic function of temperature (e.g. the Shomate equation ), then the integrals involved in calculating other parameters may be solved to yield analytic ...

  9. Acid strength - Wikipedia

    en.wikipedia.org/wiki/Acid_strength

    Acid strength is the tendency of an acid, symbolised by the chemical formula, to dissociate into a proton, +, and an anion, .The dissociation or ionization of a strong acid in solution is effectively complete, except in its most concentrated solutions.