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Eric Carlson

This document provides a decision tree for selecting appropriate equations of state and activity coefficient models for phase equilibrium calculations based on the system type and conditions. It outlines models like Wilson, NRTL, UNIQUAC, and UNIFAC for non-electrolyte systems below 10 bar pressure. For systems above 10 bar it recommends models like Schwartzentruber-Renon PR or SRK with interaction parameters. For electrolyte systems it suggests models like Electrolyte NRTL or Pitzer for non-polar electrolytes and Peng-Robinson, Redlich-Kwong-Soave, or Lee-Kesler-Plöcker for real electrolyte systems.

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VILLA KGAMADI
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104 views1 page

Eric Carlson

This document provides a decision tree for selecting appropriate equations of state and activity coefficient models for phase equilibrium calculations based on the system type and conditions. It outlines models like Wilson, NRTL, UNIQUAC, and UNIFAC for non-electrolyte systems below 10 bar pressure. For systems above 10 bar it recommends models like Schwartzentruber-Renon PR or SRK with interaction parameters. For electrolyte systems it suggests models like Electrolyte NRTL or Pitzer for non-polar electrolytes and Peng-Robinson, Redlich-Kwong-Soave, or Lee-Kesler-Plöcker for real electrolyte systems.

Uploaded by

VILLA KGAMADI
Copyright
© © All Rights Reserved
We take content rights seriously. If you suspect this is your content, claim it here.
Available Formats
Download as PDF, TXT or read online on Scribd
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Wilson, NRTL,

UNIQUAC,
or UNIFAC
NRTL, UNIQUAC with special
and their variances HEXAMERS EOS
YES for Hexamers

POLY
LLE VAPOUR PHASE
YES ASSOCIATION
Wilson, NRTL,
UNIQUAC,
DIMERS
NO UNIFAC with
WILSON, NRTL, Hayden
ij? UNIQUAC and O’Connell
P < 10 bar their variances or Nothnagel
VAP EOS
UNIFAC LLE
YES

NO NO VAPOUR
LLE PHASE
Wilson, NRTL,
ASSOCIATION
UNIQUAC, or UNIFAC and its extensions
with ideal Gas or RK EOS

NO
UNIFAC and its
extensions
PRES
NON-
ELECTROLYTE Schwartzentruber-Renon
PR or SRK with WS
INTERACTIVE PR or SRK with MHV2
PARAMETERS
ELEC
POLAR P > 10 bar
ij?
ELECTROLYTE
Electrolyte NRTL
Or Pitzer
NO PARAMETERS
POLAR PSRK
PR or SRK with MHV2
Peng-Robinson,
Redlich-Kwong-Soave,
REAL Lee-Kesler-Plöcker

ALL NON-POLAR
REAL
Chao-Seader,
Grayson-Streed or
POSITIVE Braun K-10
PRESSURE

NOT ALL REAL


VACUUM

VACUUM
Braun K-10 or ideal

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