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Record W4411225337 · doi:10.1016/j.fluid.2025.114498

Experimental and theoretical quantification of phase behaviour for solvents/water/heavy oil systems with the PC-SAFT equation of state

2025· article· en· W4411225337 on OpenAlexafffund
Yunlong Li, Lu Yang, Desheng Huang, Xiaomeng Dong, Daoyong Yang

Bibliographic record

VenueFluid Phase Equilibria · 2025
Typearticle
Languageen
FieldEngineering
TopicPhase Equilibria and Thermodynamics
Canadian institutionsUniversity of Regina
FundersNatural Sciences and Engineering Research Council of CanadaNational Natural Science Foundation of China
KeywordsChemistryEquation of statePhase (matter)ThermodynamicsOrganic chemistry

Abstract

fetched live from OpenAlex

• Phase behaviour and physical properties of solvents/heavy oil/water systems are quantified. • PC-SAFT EOS, ASP fractions, SCN-type method, and temperature-independent BIPs are integrated to reproduce the measured data. • The predicted two/three-phase boundaries exhibit an overall RMSRE of 2.50%. • Water is found to reduce phase boundaries of N 2 and CO 2 -heavy oil systems but increases them for the DME-heavy oil system. • SF of pure DME is higher than that of pure CO 2 and introducing CO 2 into DME reduces the SF. In this work, a new framework has been proposed to quantify phase behaviour of solvents-water-heavy oil systems based on the perturbed-chain statistical associating fluid theory equation of state (PC-SAFT EOS) and then compared it with the cubic EOSs (e.g., PR EOS). Experimentally, constant composition expansion (CCE) tests were meticulously conducted to measure saturation pressure ( P s a t ), phase volume, and phase compositions for CO 2 /heavy oil, N 2 /heavy oil, and dimethyl ether (DME)/heavy oil systems with and without water at pressures up to 20 MPa and temperatures up to 433.2 K. Theoretically, a PC-SAFT EOS framework incorporated temperature-independent binary interaction parameters (BIPs) is employed to reproduce the measured P s a t and other physical properties of the aforementioned systems. Addition of water into each of the aforementioned systems is found to increase its P s a t compared to the systems without water. By characterizing heavy oil as four pseudocomponents, density of the aforementioned systems can be accurately predicted with the root-mean-squared relative error (RMSRE) of 1.84%. Then, the BIPs for each binary pair of the aforementioned systems are obtained by minimizing the deviation between the experimentally measured P s a t and the corresponding calculated values. Compared with the modified PR EOS, the proposed framework shows its superior performance with an RMSRE of 2.93% for the predicted P s a t of the aforementioned systems.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.455
Threshold uncertainty score0.574

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0000.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.015
GPT teacher head0.282
Teacher spread0.267 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one teacher head, not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations2
Published2025
Admission routes2
Has abstractyes

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