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Object[Analysis, Thermodynamics]

Calculation of the thermodynamic properties of a reaction using van't Hoff analysis of melting point data.

Organizational Information

    Name

    Name of this Object.
    Format: Single
    Class: String
    Programmatic Pattern: _String
    Pattern Description: A string.

    ID

    ID of this Object.
    Format: Single
    Class: String
    Programmatic Pattern: _String
    Pattern Description: The ID of this object.

    Object

    Object of this Object.
    Format: Single
    Class: Expression
    Programmatic Pattern: Object[Analysis, Thermodynamics, _String]
    Pattern Description: The object reference of this object.

    Type

    Type of this Object.
    Format: Single
    Class: Expression
    Programmatic Pattern: Object[Analysis, Thermodynamics]
    Pattern Description: Object[Analysis, Thermodynamics]

    Notebook

    Notebook this object belongs to.
    Format: Single
    Class: Link
    Programmatic Pattern: _Link
    Pattern Description: An object of that matches ObjectP[Object[LaboratoryNotebook]].
    Relation: Object[LaboratoryNotebook][Objects]

    Author

    The person who ran the analysis.
    Format: Single
    Class: Link
    Programmatic Pattern: _Link
    Relation: Object[User]

General

Analysis & Reports

    Fit

    The van't Hoff fit on the data to generate the enthalpy and entropy.
    Format: Single
    Class: Link
    Programmatic Pattern: _Link
    Relation: Object[Analysis][Reference]

    Enthalpy

    The change in enthalpy as determined from the melting curve fit.
    Format: Single
    Class: Real
    Unit: 1 thermochemical kilocalorie per mole
    Programmatic Pattern: _?EnergyQ

    EnthalpyStandardDeviation

    Uncertainty in the computed enthalpy, defined as the standard deviation of the enthalpy distribution.
    Format: Single
    Class: Real
    Unit: 1 thermochemical kilocalorie per mole
    Programmatic Pattern: _?EnergyQ

    EnthalpyDistribution

    The probability distribution for the computed enthalpy value.
    Format: Single
    Class: Expression
    Programmatic Pattern: DistributionP[KilocaloriePerMole]

    Entropy

    The change in entropy as determined from the melting curve fit.
    Format: Single
    Class: Real
    Unit: 1 thermochemical calorie per kelvin mole
    Programmatic Pattern: _?EntropyQ

    EntropyStandardDeviation

    Uncertainty in the computed entropy, defined as the standard deviation of the entropy distribution.
    Format: Single
    Class: Real
    Unit: 1 thermochemical calorie per kelvin mole
    Programmatic Pattern: _?EntropyQ

    EntropyDistribution

    The probability distribution for the computed entropy value.
    Format: Single
    Class: Expression
    Programmatic Pattern: DistributionP[CaloriePerMoleKelvin]

    FreeEnergy

    The gibbs free energy at 37 Celsius, computed from the BindingEnthalpy and BindingEntropy.
    Format: Single
    Class: Real
    Unit: 1 thermochemical kilocalorie per mole
    Programmatic Pattern: _?EnergyQ

    FreeEnergyStandardDeviation

    Uncertainty in the computed free energy, defined as the standard deviation of the binding free energy distribution.
    Format: Single
    Class: Real
    Unit: 1 thermochemical kilocalorie per mole
    Programmatic Pattern: _?EnergyQ

    FreeEnergyDistribution

    The probability distribution for the computed free energy value.
    Format: Single
    Class: Expression
    Programmatic Pattern: DistributionP[KilocaloriePerMole]
Last modified on Mon 26 Sep 2022 15:43:43
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