A US perspective on closing the carbon cycle to defossilize difficult-to-electrify segments of our economy

WJ Shaw, MK Kidder, SR Bare, M Delferro… - Nature Reviews …, 2024 - nature.com
Electrification to reduce or eliminate greenhouse gas emissions is essential to mitigate
climate change. However, a substantial portion of our manufacturing and transportation …

[HTML][HTML] A review and perspective on hybrid modelling methodologies

AM Schweidtmann, D Zhang, M von Stosch - Digital Chemical Engineering, 2023 - Elsevier
The term hybrid modeling refers to the combination of parametric models (typically derived
from knowledge about the system) and nonparametric models (typically deduced from data) …

Learning and optimization under epistemic uncertainty with Bayesian hybrid models

EA Eugene, KD Jones, X Gao, J Wang… - Computers & Chemical …, 2023 - Elsevier
Abstract Hybrid (ie, grey-box) models are a powerful and flexible paradigm for predictive
science and engineering. Grey-box models use data-driven constructs to incorporate …

Vision 2050: Reaction Engineering Roadmap

P Bollini, M Diwan, P Gautam, RL Hartman… - ACS Engineering …, 2023 - ACS Publications
This perspective provides the collective opinions of a dozen chemical reaction engineers
from academia and industry. In this sequel to the “Vision 2020: Reaction Engineering …

Towards artificial intelligence at scale in the chemical industry

LH Chiang, B Braun, Z Wang, I Castillo - AIChE Journal, 2022 - Wiley Online Library
Abstract In the Industry 4.0 era, the chemical industry is embracing broad adoption of
artificial intelligence (AI) and machine learning (ML) methods. This article provides a holistic …

Risk Minimization in Scale-Up of Biomass and Waste Carbon Upgrading Processes

JH Miller, CT Nimlos, Y Li, AC Young… - ACS Sustainable …, 2023 - ACS Publications
Improving the odds and pace of successful biomass and waste carbon utilization technology
scale-up is crucial to decarbonizing key industries such as aviation and materials within …

Deep eutectic melt of betaine and trichloroacetic acid; its anomalous thermal behavior and green promotion effect in selective synthesis of benzimidazoles

Z Fadaei, K Rad-Moghadam - Journal of Molecular Liquids, 2024 - Elsevier
Trichloroacetic acid and betaine form glassy liquids on melting together in some molar
ratios, of which the melt with mole fraction of trichloroacetic acid about 0.83 displayed the …

[HTML][HTML] Predictive models for upstream mammalian cell culture development-A review

BS Yatipanthalawa, SL Gras - Digital Chemical Engineering, 2023 - Elsevier
The production of therapeutic proteins in mammalian cell culture is an essential unit
operation in biopharmaceutical manufacture that can benefit from the predictive insights of …

Multiple linear regression and GRU model for the online prediction of catalyst activity and lifetime in counter-current continuous catalytic reforming

Y Shin, M Park, J Lee, K Kang, S Wang, E Lee… - Korean Journal of …, 2023 - Springer
In the catalytic reforming process, aromatic yield is a standard for evaluating the production
quality of the process, and studies are underway to improve productivity by optimizing the …

Constructing Time-varying and History-dependent Kinetic Models Via Reinforcement Learning

M Mowbray, EA Del Rio Chanona, D Zhang - 2023 - books.rsc.org
Mathematical modelling provides a significant contribution to the understanding and design
of chemical and biochemical reaction processes. For instance, for biochemical reaction …