Thermodynamic properties of solids

Thermodynamic properties of solids

Home Forums CRYSTAL running issues Thermodynamic properties of solids

This topic contains 1 reply, has 1 voice, and was last updated by  crystal 3 years, 10 months ago.

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  • #116

    crystal
    Keymaster

    Is Crystal program can be used to assess physical chemistry topics theoritically e.g.(Thermodynamics, Gibss free energy, enthalpy, entrophy, surface tension, study about temperature effect in reaction)?

  • #117

    crystal
    Keymaster

    Thermodynamic properties of solids can be computed with the CRYSTAL program
    from harmonic vibration frequencies by exploiting the statistical thermodynamics laws.

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