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  2. Acid dissociation constant - Wikipedia

    en.wikipedia.org/wiki/Acid_dissociation_constant

    Free energy is made up of an enthalpy term and an entropy term. [11] = The standard enthalpy change can be determined by calorimetry or by using the van 't Hoff equation, though the calorimetric method is preferable. When both the standard enthalpy change and acid dissociation constant have been determined, the standard entropy change is easily ...

  3. Metal ions in aqueous solution - Wikipedia

    en.wikipedia.org/wiki/Metal_ions_in_aqueous_solution

    This quantity with the dimension of time is useful because it is independent of concentration. The quantity 1/k, also with dimension of time, equal to the half life divided by 0.6932, is known as the residence time or time constant. [77] The residence time for water exchange varies from about 10 −10 s for Cs + to about 10 +10 s (more than 200 ...

  4. PKA (irradiation) - Wikipedia

    en.wikipedia.org/wiki/PKA_(irradiation)

    In its path, a PKA can produce effects similar to those of heating and rapidly quenching a metal, resulting in Frenkel defects. A thermal spike does not last long enough to permit annealing of the Frenkel defects. [1] [2] A different model called the displacement spike was proposed for fast neutron bombardment of heavy elements.

  5. Entropy as an arrow of time - Wikipedia

    en.wikipedia.org/wiki/Entropy_as_an_arrow_of_time

    The idea that we can remember the past and not the future is called the "psychological arrow of time" and it has deep connections with Maxwell's demon and the physics of information; memory is linked to the second law of thermodynamics if one views it as correlation between brain cells (or computer bits) and the outer world: Since such ...

  6. Cation–π interaction - Wikipedia

    en.wikipedia.org/wiki/Cation–π_interaction

    Any intermediating solvent molecule will attenuate the effect, because the energy gained by the cation–π interaction is partially offset by the loss of solvation energy. For a given cation–π adduct, the interaction energy decreases with increasing solvent polarity. This can be seen by the following calculated interaction energies of ...

  7. Negative energy - Wikipedia

    en.wikipedia.org/wiki/Negative_energy

    The negative-energy particle then crosses the event horizon into the black hole, with the law of conservation of energy requiring that an equal amount of positive energy should escape. In the Penrose process , a body divides in two, with one half gaining negative energy and falling in, while the other half gains an equal amount of positive ...

  8. Protein pKa calculations - Wikipedia

    en.wikipedia.org/wiki/Protein_pKa_calculations

    In this case, one can use various free energy calculation methods to obtain the protonation free energy [15] such as biased Metropolis MC, [24] free-energy perturbation, [25] [26] thermodynamic integration, [27] [28] [29] the non-equilibrium work method [30] or the Bennett acceptance ratio method. [31] Note that the pK HH

  9. Hammett acidity function - Wikipedia

    en.wikipedia.org/wiki/Hammett_acidity_function

    The Hammett acidity function (H 0) is a measure of acidity that is used for very concentrated solutions of strong acids, including superacids.It was proposed by the physical organic chemist Louis Plack Hammett [1] [2] and is the best-known acidity function used to extend the measure of Brønsted–Lowry acidity beyond the dilute aqueous solutions for which the pH scale is useful.