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Record W7117681821 · doi:10.1021/acs.iecr.5c02735

Dynamic Surrogate Modeling Using Latent Variable Methods and Neural Networks for Market-Driven Operation of an Air Separation Unit

2025· article· en· W7117681821 on OpenAlexaff
Kieran McKenzie, Christopher L.E. Swartz, Brandon Corbett

Bibliographic record

VenueIndustrial & Engineering Chemistry Research · 2025
Typearticle
Languageen
FieldEngineering
TopicProcess Optimization and Integration
Canadian institutionsMcMaster University
Fundersnot available
KeywordsSurrogate modelArtificial neural networkLatent variableOptimization problemSubspace topologyPrincipal component analysisComputation

Abstract

fetched live from OpenAlex

This work presents a dynamic surrogate modeling framework that combines latent variable methods and neural networks for accurate and computationally efficient market-driven dynamic optimization of an air separation plant. The high-dimensional full-order model (FOM) consisting of ≈ 3800 states is projected onto a 10-dimensional latent subspace using principal component analysis (PCA). Following order reduction, a rectified linear unit (ReLU)-activated multilayer perceptron (MLP) neural network is trained to compute step-ahead predictions of the latent states in addition to the squared prediction error (SPE) statistic of the step-ahead prediction. The ReLU network is embedded directly into a discrete time reformulation of the optimization problem using complementarity conditions, and a trust region is enforced during optimization by constraining the SPE along the prediction horizon to be within specified confidence limits. The latent variable-based surrogate model (LV-SM) is validated through multistep-ahead simulation case studies, demonstrating high prediction accuracy for restoration of not only the states directly relevant to optimization but also the entire original state-space. The LV-SM’s performance in dynamic optimization is studied using a market-driven optimization case study, where it achieves a solution nearly identical to the FOM with nearly 3 orders of magnitude reduction in computation time using a two-tiered optimization approach. The results of this work highlight the potential of the LV-SM as a substitute for high-dimensional and complex first-principles-based industrial process models, particularly for use in real-time operations applications.

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 machine prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.

metaresearch head score (Codex)0.001
metaresearch head score (Gemma)0.002
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Simulation or modeling · Consensus signal: Simulation or modeling
GenreCandidate signal: Empirical · Consensus signal: none
Teacher disagreement score0.004
Threshold uncertainty score0.009

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0010.002
Meta-epidemiology (narrow)0.0010.000
Meta-epidemiology (broad)0.0010.001
Bibliometrics0.0000.000
Science and technology studies0.0000.001
Scholarly communication0.0010.001
Open science0.0010.001
Research integrity0.0010.001
Insufficient payload (model declined to judge)0.0010.000

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 head0.091
GPT teacher head0.410
Teacher spread0.320 · 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 source (direct Gemma or distilled Codex), not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designSimulation or modeling
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

Citations1
Published2025
Admission routes1
Has abstractyes

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