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  2. Equilibrium constant - Wikipedia

    en.wikipedia.org/wiki/Equilibrium_constant

    This equation can be used to calculate the value of log K at a temperature, T 2, knowing the value at temperature T 1. The van 't Hoff equation also shows that, for an exothermic reaction ( Δ H < 0 {\displaystyle \Delta H<0} ), when temperature increases K decreases and when temperature decreases K increases, in accordance with Le Chatelier's ...

  3. Determination of equilibrium constants - Wikipedia

    en.wikipedia.org/wiki/Determination_of...

    The most widely used electrode is the glass electrode, which is selective for the hydrogen ion. This is suitable for all acid–base equilibria. log 10 β values between about 2 and 11 can be measured directly by potentiometric titration using a glass electrode.

  4. Free-energy relationship - Wikipedia

    en.wikipedia.org/wiki/Free-energy_relationship

    In physical organic chemistry, a free-energy relationship or Gibbs energy relation relates the logarithm of a reaction rate constant or equilibrium constant for one series of chemical reactions with the logarithm of the rate or equilibrium constant for a related series of reactions. [1]

  5. Acid dissociation constant - Wikipedia

    en.wikipedia.org/wiki/Acid_dissociation_constant

    In particular, the pH of a solution can be predicted when the analytical concentration and pK a values of all acids and bases are known; conversely, it is possible to calculate the equilibrium concentration of the acids and bases in solution when the pH is known. These calculations find application in many different areas of chemistry, biology ...

  6. Gibbs free energy - Wikipedia

    en.wikipedia.org/wiki/Gibbs_free_energy

    In thermodynamics, the Gibbs free energy (or Gibbs energy as the recommended name; symbol ) is a thermodynamic potential that can be used to calculate the maximum amount of work, other than pressure–volume work, that may be performed by a thermodynamically closed system at constant temperature and pressure.

  7. Gaussian (software) - Wikipedia

    en.wikipedia.org/wiki/Gaussian_(software)

    Gaussian / ˈ ɡ aʊ s i ə n / is a general purpose computational chemistry software package initially released in 1970 by John Pople [1] [2] and his research group at Carnegie Mellon University as Gaussian 70. [3] It has been continuously updated since then. [4]

  8. Wikipedia : WikiProject Chemicals/Data

    en.wikipedia.org/wiki/Wikipedia:WikiProject...

    Chemistry resources is a collection of links and references that are useful for chemistry-related work. This includes free online chemical databases , publications, patents , computer programs , and various tools.

  9. Activity coefficient - Wikipedia

    en.wikipedia.org/wiki/Activity_coefficient

    In thermodynamics, an activity coefficient is a factor used to account for deviation of a mixture of chemical substances from ideal behaviour. [1] In an ideal mixture, the microscopic interactions between each pair of chemical species are the same (or macroscopically equivalent, the enthalpy change of solution and volume variation in mixing is zero) and, as a result, properties of the mixtures ...