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  2. 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.

  3. Free-energy perturbation - Wikipedia

    en.wikipedia.org/wiki/Free-energy_perturbation

    This free-energy map is also known as a potential of mean force (PMF). Free-energy perturbation calculations only converge properly when the difference between the two states is small enough; therefore it is usually necessary to divide a perturbation into a series of smaller "windows", which are computed independently.

  4. Gibbs–Helmholtz equation - Wikipedia

    en.wikipedia.org/wiki/Gibbs–Helmholtz_equation

    This equation quickly enables the calculation of the Gibbs free energy change for a chemical reaction at any temperature T 2 with knowledge of just the standard Gibbs free energy change of formation and the standard enthalpy change of formation for the individual components. Also, using the reaction isotherm equation, [8] that is

  5. Table of thermodynamic equations - Wikipedia

    en.wikipedia.org/wiki/Table_of_thermodynamic...

    Helmholtz free energy: A, F = J ML 2 T −2: Landau potential, Landau free energy, Grand potential: Ω, Φ G = J ML 2 T −2: Massieu potential, Helmholtz free entropy: Φ = / J⋅K −1: ML 2 T −2 Θ −1: Planck potential, Gibbs free entropy: Ξ

  6. Helmholtz free energy - Wikipedia

    en.wikipedia.org/wiki/Helmholtz_free_energy

    In thermodynamics, the Helmholtz free energy (or Helmholtz energy) is a thermodynamic potential that measures the useful work obtainable from a closed thermodynamic system at a constant temperature . The change in the Helmholtz energy during a process is equal to the maximum amount of work that the system can perform in a thermodynamic process ...

  7. Surface energy - Wikipedia

    en.wikipedia.org/wiki/Surface_energy

    Calculation of surface energy from first principles (for example, density functional theory) is an alternative approach to measurement. Surface energy is estimated from the following variables: width of the d-band, the number of valence d-electrons, and the coordination number of atoms at the surface and in the bulk of the solid. [5] [page needed]

  8. Thermodynamic free energy - Wikipedia

    en.wikipedia.org/wiki/Thermodynamic_free_energy

    Therefore, only relative free energy values, or changes in free energy, are physically meaningful. The free energy is the portion of any first-law energy that is available to perform thermodynamic work at constant temperature, i.e., work mediated by thermal energy. Free energy is subject to irreversible loss in the course of such work. [1]

  9. Thermodynamic equations - Wikipedia

    en.wikipedia.org/wiki/Thermodynamic_equations

    Only one equation of state will not be sufficient to reconstitute the fundamental equation. All equations of state will be needed to fully characterize the thermodynamic system. Note that what is commonly called "the equation of state" is just the "mechanical" equation of state involving the Helmholtz potential and the volume: