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  2. Solvation - Wikipedia

    en.wikipedia.org/wiki/Solvation

    The solvation energy (change in Gibbs free energy) is the change in enthalpy minus the product of temperature (in Kelvin) times the change in entropy. Gases have a negative entropy of solution, due to the decrease in gaseous volume as gas dissolves.

  3. Enthalpy change of solution - Wikipedia

    en.wikipedia.org/wiki/Enthalpy_change_of_solution

    Forming solvent–solute attractions , in solvation. The value of the enthalpy of solvation is the sum of these individual steps: = +. Dissolving ammonium nitrate in water is endothermic. The energy released by the solvation of the ammonium ions and nitrate ions is less than the energy absorbed in breaking up the ammonium nitrate ionic lattice ...

  4. Implicit solvation - Wikipedia

    en.wikipedia.org/wiki/Implicit_solvation

    The free energy of solvation of a solute molecule in the simplest ASA-based method is given by: = where is the accessible surface area of atom i, and is solvation parameter of atom i, i.e., a contribution to the free energy of solvation of the particular atom i per surface unit area.

  5. Born equation - Wikipedia

    en.wikipedia.org/wiki/Born_equation

    The Born equation can be used for estimating the electrostatic component of Gibbs free energy of solvation of an ion. It is an electrostatic model that treats the solvent as a continuous dielectric medium (it is thus one member of a class of methods known as continuum solvation methods). It was derived by Max Born. [1] [2]

  6. Hydration energy - Wikipedia

    en.wikipedia.org/wiki/Hydration_energy

    If the hydration energy is greater than the lattice energy, then the enthalpy of solution is negative (heat is released), otherwise it is positive (heat is absorbed). [3]The hydration energy should not be confused with solvation energy, which is the change in Gibbs free energy (not enthalpy) as solute in the gaseous state is dissolved. [4]

  7. Free-energy relationship - Wikipedia

    en.wikipedia.org/wiki/Free-energy_relationship

    Free energy relationships establish the extent at which bond formation and breakage happen in the transition state of a reaction, and in combination with kinetic isotope experiments a reaction mechanism can be determined. Free energy relationships are often used to calculate equilibrium constants since they are experimentally difficult to ...

  8. File:Solvation Energy Diagram.svg - Wikipedia

    en.wikipedia.org/wiki/File:Solvation_Energy...

    English: Energy diagram illustrating the Franck–Condon principle applied to the solvation of chromophores. The parabolic potential curves symbolize the interaction energy between the chromophores and the solvent. The Gaussian curves represent the distribution of this interaction energy.

  9. Marcus theory - Wikipedia

    en.wikipedia.org/wiki/Marcus_theory

    Thus the reorganization energy for chemical redox reactions, which is a Gibbs free energy, is also a parabolic function of Δe of this hypothetical transfer, For the self exchange reaction, where for symmetry reasons Δe = 0.5, the Gibbs free energy of activation is ΔG(0) ‡ = λ o /4 (see Fig. 1 and Fig. 2 intersection of the parabolas I and ...