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Aspen Physical Property System - Physical Property Models

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Then I2(�) and I3(�) are computed in terms of � by the expressions:<br />

Reference<br />

Jog, P. K., Sauer, S. G., Blaesing, J., & Chapman, W. G. (2001), Application<br />

of Dipolar Chain Theory to the Phase Behavior of Polar Fluids and Mixtures.<br />

Ind. Eng. Chem. Res., 40, 4641.<br />

Rushbrooke, G. S., & Stell, G., Hoye, J. S. (1973), Molec. Phys., 26, 1199.<br />

Copolymer PC-SAFT EOS Model Parameters<br />

Pure parameters<br />

Each non-association species (solvent or segment) must have a set of three<br />

pure-component parameter; two of them are the segment diameter � and the<br />

segment energy parameter �. The third parameter for a solvent is the<br />

segment number m and for a segment is the segment ratio parameter r. For<br />

an association species, two additional parameters are the effective association<br />

volume � (AB) and the association energy � (AB) . For a polar species, two<br />

additional parameters are the dipole moment � and the segment dipolar<br />

fraction xp.<br />

Binary parameters<br />

There are three types of binary interactions in copolymer systems: solventsolvent,<br />

solvent-segment, and segment-segment. The binary interaction<br />

parameter �i�,j� allows complex temperature dependence:<br />

with<br />

where Tref is a reference temperature and the default value is 298.15 K.<br />

The following table lists the copolymer PC-SAFT EOS model parameters<br />

implemented in <strong>Aspen</strong> Plus:<br />

2 Thermodynamic <strong>Property</strong> <strong>Models</strong> 45

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