Design of computer experiments: A review

SS Garud, IA Karimi, M Kraft - Computers & Chemical Engineering, 2017 - Elsevier
In this article, we present a detailed overview of the literature on the design of computer
experiments. We classify the existing literature broadly into two categories, viz. static and …

Advanced biofuels and beyond: chemistry solutions for propulsion and production

W Leitner, J Klankermayer, S Pischinger… - Angewandte Chemie …, 2017 - Wiley Online Library
Sustainably produced biofuels, especially when they are derived from lignocellulosic
biomass, are being discussed intensively for future ground transportation. Traditionally …

Combustion in the future: The importance of chemistry

K Kohse-Höinghaus - Proceedings of the Combustion Institute, 2021 - Elsevier
Combustion involves chemical reactions that are often highly exothermic. Combustion
systems utilize the energy of chemical compounds released during this reactive process for …

A standardized methodology for the techno-economic evaluation of alternative fuels–A case study

FG Albrecht, DH König, N Baucks, RU Dietrich - Fuel, 2017 - Elsevier
Greenhouse gas emissions in the transport sector can significantly be reduced by replacing
fossil based fuels with green alternatives. Various alternative fuel concepts have been …

Are open source energy system optimization tools mature enough for serious use?

M Groissböck - Renewable and Sustainable Energy Reviews, 2019 - Elsevier
Historically, energy system tools were predominantly proprietary and not shared with others.
In recent years, there has been an increase in developing open source tools by international …

[HTML][HTML] Chemical data intelligence for sustainable chemistry

JM Weber, Z Guo, C Zhang… - Chemical Society …, 2021 - pubs.rsc.org
This study highlights new opportunities for optimal reaction route selection from large
chemical databases brought about by the rapid digitalisation of chemical data. The chemical …

A systems level analysis of ethanol upgrading strategies to middle distillates

JM Restrepo-Flórez, J Ryu, D Witkowski… - Energy & …, 2022 - pubs.rsc.org
We systematically study the upgrading of ethanol toward middle distillates with desired
properties. To survey the large design space, we introduce a novel superstructure-based …

A generalized superstructure-based framework for process synthesis

J Ryu, L Kong, AEP de Lima, CT Maravelias - Computers & Chemical …, 2020 - Elsevier
We propose a general framework for the formulation of superstructure-based optimization
models for holistic process synthesis. First, we redefine the fundamental problems of reactor …

A generic superstructure modeling and optimization framework on the example of bi-criteria Power-to-Methanol process design

P Kenkel, T Wassermann, C Rose… - Computers & Chemical …, 2021 - Elsevier
This work presents a fully open-source superstructure optimization model for bi-criteria
process design optimization. This model is implemented in the Open sUperstrucTure …

Generalized optimization-based synthesis of membrane systems for multicomponent gas mixture separation

GSP Taifan, CT Maravelias - Chemical Engineering Science, 2022 - Elsevier
Synthesizing a membrane system to separate multicomponent gas mixture is challenging
due to the combinatorial number of feasible configurations and the difficulties in describing …