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Acetic acid recovery — NRTL with vapor-phase dimerization

DistillationNRTLAcetic acidVapor association
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Concentrating dilute aqueous acetic acid (30 mol%) by distillation, modeled with the NRTL activity package and chemical-theory vapor-phase association (acetic acid dimerizes, 2 A -> A2, in the vapor). This is the physics a cubic equation of state gets wrong: the pinned NRTL acetic-acid/water binary (DECHEMA) plus the cited dimerization constants (Nagy et al., Molecules 2020) give the real bubble curve and latent heat, so the close-boiling acid/water pair actually separates and converges where Peng-Robinson does not. Honesty note: acetic acid and water are close-boiling with no azeotrope, so neither product is sharp at this screening duty — the bottoms comes out ~79 mol% acid and the distillate ~91 mol% water. Both are the solver's own converged, mass-closing answer; a sharper cut needs a taller column at higher reflux than 20 stages / R=1.6, and at that duty this column stops closing its component balance (see the CLAUDE.md note), so the honest result is reported rather than the target quoted.

The flowsheet

The solved topology — every unit op's real duty, conversion, or split, read straight off a genuine converged solve.

FEED
feed
dist
btms
Qc
Qr
COL
Water
ACID

The stream table

Every stream's flow, temperature, pressure, and composition — real converged numbers, not placeholders.

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