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When calling a function that returns one or more properties the user has the option to have the function either a user defined set of values spanning one row or a fixed output spanning a number of rows.
This is controlled by the parameter:
•Output
Below is a table that gives the options for Output:
NR.
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Value of "Output"
Note: Only the short name is currently active.
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Returning:
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Notes
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1
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Bonding fraction (BF)
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Fraction of sites not bonded
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Only relevant when the association scheme is used.
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2
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Temperature (T)
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Temperature given or found depending of calculation
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3
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Pressure (P)
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Pressure given or found depending of calculation
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4
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Volume (V)
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Volume of the given phase
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5
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Density (D)
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Density of the given phase
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6
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Enthalpy (H)
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Enthalpy in the given phase
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7
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Entropy (S)
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Entropy in the given phase
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8
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Cp
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Heat capacity in the given phase
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9
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Molar mass (M)
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Average molar mass of the phase
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10
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Mn
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Mn for the distribution
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Only active for a system with a polymer
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11
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Mw
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Mw for the distribution
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Only active for a system with a polymer
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12
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Mz
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Mz for the distribution
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Only active for a system with a polymer
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Example
#1
We want to return volume and density:
Output = "V, D"
#2
We want to return temperature, pressure and enthalpy
Output = "T, P, H"
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