A contribution to support decision making in energy/water sypply chain optimisation

The seeking of process sustainability forces enterprises to change their operations. Additionally, the industrial globalization implies a very dynamic market that, among other issues, promotes the enterprises competition. Therefore, the efficient control and use of their Key Performance Indicators, including profitability, cost reduction, demand satisfaction and environmental impact associated to the development of new products, is a significant challenge. All the above indicators can be efficiently controlled through the Supply Chain Management. Thus, companies work towards the optimization of their individual operations under competitive environments taking advantage of the flexibility provided by the virtually inexistent world market restrictions. This is achieved by the coordination of the resource flows, across all the entities and echelons belonging to the system network. Nevertheless, such coordination is significantly complicated if considering the presence of uncertainty and even more if seeking for a win-win outcome. The purpose of this thesis is extending the current decision making strategies to expedite these tasks in industrial processes. Such a contribution is based on the development of efficient mathematical models that allows coordinating large amount of information synchronizing the production and distribution tasks in terms of economic, environmental and social criteria. This thesis starts presents an overview of the requirements of sustainable production processes, describing and analyzing the current methods and tools used and identifying the most relevant open issues. All the above is always within the framework of Process System Engineering literature. The second part of this thesis is focused in stressing the current Multi-Objective solution strategies. During this part, first explores how the profitability of the Supply Chain can be enhanced by considering simultaneously multiple objectives under demand uncertainties. Particularly, solution frameworks have been proposed in which different multi-criteria decision making strategies have been combined with stochastic approaches. Furthermore, additional performance indicators (including financial and operational ones) have been included in the same solution framework to evaluate its capabilities. This framework was also applied to decentralized supply chains problems in order to explore its capabilities to produce solution that improves the performances of each one of the SC entities simultaneously. Consequently, a new generalized mathematical formulation which integrates many performance indicators in the production process within a supply chain is efficiently solved. Afterwards, the third part of the thesis extends the proposed solution framework to address the uncertainty management. Particularly, the consideration of different types and sources of uncertainty (e.g. external and internal ones) where considered, through the implementation of preventive approaches. This part also explores the use of solution strategies that efficiently selects the number of scenarios that represent the uncertainty conditions. Finally, the importance and effect of each uncertainty source over the process performance is detailed analyzed through the use of surrogate models that promote the sensitivity analysis of those uncertainties. The third part of this thesis is focused on the integration of the above multi-objective and uncertainty approaches for the optimization of a sustainable Supply Chain. Besides the integration of different solution approaches, this part also considers the integration of hierarchical decision levels, by the exploitation of mathematical models that assess the consequences of considering simultaneously design and planning decisions under centralized and decentralized Supply Chains. Finally, the last part of this thesis provides the final conclusions and further work to be developed.La globalización industrial genera un ambiente dinámico en los mercados que, entre otras cosas, promueve la competencia entre corporaciones. Por lo tanto, el uso eficiente de las los indicadores de rendimiento, incluyendo rentabilidad, satisfacción de la demanda y en general el impacto ambiental, representa un area de oportunidad importante. El control de estos indicadores tiene un efecto positivo si se combinan con la gestión de cadena de suministro. Por lo tanto, las compañías buscan definir sus operaciones para permanecer activas dentro de un ambiente competitivo, tomando en cuenta las restricciones en el mercado mundial. Lo anterior puede ser logrado mediante la coordinación de los flujos de recursos a través de todas las entidades y escalones pertenecientes a la red del sistema. Sin embargo, dicha coordinación se complica significativamente si se quiere considerar la presencia de incertidumbre, y aún más, si se busca exclusivamente un ganar-ganar. El propósito de esta tesis es extender el alcance de las estrategias de toma de decisiones con el fin de facilitar estas tareas dentro de procesos industriales. Estas contribuciones se basan en el desarrollo de modelos matemáticos eficientes que permitan coordinar grandes cantidades de información sincronizando las tareas de producción y distribución en términos económicos, ambientales y sociales. Esta tesis inicia presentando una visión global de los requerimientos de un proceso de producción sostenible, describiendo y analizando los métodos y herramientas actuales así como identificando las áreas de oportunidad más relevantes dentro del marco de ingeniería de procesos La segunda parte se enfoca en enfatizar las capacidades de las estrategias de solución multi-objetivo, durante la cual, se explora el mejoramiento de la rentabilidad de la cadena de suministro considerando múltiples objetivos bajo incertidumbres en la demanda. Particularmente, diferentes marcos de solución han sido propuestos en los que varias estrategias de toma de decisión multi-criterio han sido combinadas con aproximaciones estocásticas. Por otra parte, indicadores de rendimiento (incluyendo financiero y operacional) han sido incluidos en el mismo marco de solución para evaluar sus capacidades. Este marco fue aplicado también a problemas de cadenas de suministro descentralizados con el fin de explorar sus capacidades de producir soluciones que mejoran simultáneamente el rendimiento para cada uno de las entidades dentro de la cadena de suministro. Consecuentemente, una nueva formulación que integra varios indicadores de rendimiento en los procesos de producción fue propuesta y validada. La tercera parte de la tesis extiende el marco de solución propuesto para abordar el manejo de incertidumbres. Particularmente, la consideración de diferentes tipos y fuentes de incertidumbre (p.ej. externos e internos) fueron considerados, mediante la implementación de aproximaciones preventivas. Esta parte también explora el uso de estrategias de solución que elige eficientemente el número de escenarios necesario que representan las condiciones inciertas. Finalmente, la importancia y efecto de cada una de las fuentes de incertidumbre sobre el rendimiento del proceso es analizado en detalle mediante el uso de meta modelos que promueven el análisis de sensibilidad de dichas incertidumbres. La tercera parte de esta tesis se enfoca en la integración de las metodologías de multi-objetivo e incertidumbre anteriormente expuestas para la optimización de cadenas de suministro sostenibles. Además de la integración de diferentes métodos. Esta parte también considera la integración de diferentes niveles jerárquicos de decisión, mediante el aprovechamiento de modelos matemáticos que evalúan lasconsecuencias de considerar simultáneamente las decisiones de diseño y planeación de una cadena de suministro centralizada y descentralizada. La parte final de la tesis detalla las conclusiones y el trabajo a futuro necesario sobre esta línea de investigaciónPostprint (published version

From conceptual design to process design optimization: a review on flowsheet synthesis

International audienceThis paper presents the authors’ perspectives on some of the open questions and opportunities in Process Systems Engineering (PSE) focusing on process synthesis. A general overview of process synthesis is given, and the difference between Conceptual Design (CD) and Process Design (PD) is presented using an original ternary diagram. Then, a bibliometric analysis is performed to place major research team activities in the latter. An analysis of ongoing work is conducted and some perspectives are provided based on the analysis. This analysis includes symbolic knowledge representation concepts and inference techniques, i.e., ontology, that is believed to become useful in the future. Future research challenges that process synthesis will have to face, such as biomass transformation, shale production, response to spaceflight demand, modular plant design, and intermittent production of energy, are also discussed

Integrated batch process development based on mixed-logic dynamic optimization

Specialty chemicals industry relies on batch manufacturing, since it requires the frequent adaptation of production systems to market fluctuations. To be first in the market, batch industry requires decision-support systems for the rapid development and implementation of chemical processes. Moreover, the processes should be competitive to ensure their long-term viability. General-purpose and flexible plants and the consideration of physicochemical insights to define an efficient operation are also cornerstones for the success of specialty chemical industries. Precisely, this thesis tackles the systematic development of batch processes that are efficient, economically competitive, and environmentally friendly, to assist their agile introduction into production systems in grassroots and retrofit scenarios. Synthesis of conceptual processing schemes and plant allocation subproblems are solved simultaneously, taking into account the plant design. With this purpose, an optimization-based approach is proposed, where all structural alternatives are represented in a State-Equipment Network (SEN) superstructure, following formulated into a Mixed-Logic Dynamic Optimization (MLDO) problem which is later solved to minimize an objective function. Essentially, the strength of the proposed methodology lies in the modeling strategy which combines the different kinds of decisions of the integrated problem in a unique optimization model. Accordingly, it considers: (i) synthesis and allocation alternatives combination, (ii) dynamic process performance models and dynamic control variable profiles, (iii) discrete events associated to transitions of batch phases and operations, (iv) quantitative and qualitative information, (v) material transference synchronization to ensure batch integrity between unit procedures, and (vi) batch and semicontinuous processing elements. Different strategies can be used to solve the resulting MLDO problem. A deterministic direct-simultaneous approach is first proposed. The mixed-logic problem is reformulated into a mixed-integer one, which is fully-discretized to provide a Mixed-Integer Non-Linear Programming (MINLP) that is optimized using conventional solvers. Then, a Differential Genetic Algorithm (DGA) and a hybrid approach are presented. The purpose of these evolutionary strategies is to pose solution alternatives that keep solution goodness while seek for the improvement of computational efficiency to handle industrial-size problems. The optimization-based approach is applied in retrofit scenarios to solve the simultaneous process synthesis and plant allocation, taking into account the physical restrictions of existing plant elements. The production of specialty chemicals based on a competitive reactions system in an existing reactor network is first defined through process development and improvement according to different economic scenarios, decision criteria, and plant modifications. Additionally, a photo-Fenton process is optimized to eliminate an emergent wastewater pollutant in a given pilot plant, pursuing the minimization of processing time and cost. Batch process development in grassroots scenarios is also proven to be a problem of utmost importance to deal with uncertainty in future markets. Seeking for plant flexibility in several demand scenarios, the expected profit is maximized through a two-stage stochastic formulation that includes simultaneous plant design, process synthesis, and plant allocation decisions. A heuristic solution algorithm is used to handle the problem complexity. A grassroots plant design is defined to implement the previous competitive reaction system, where decisions like the feed-forward trajectories or operating modes allow the adaptation of master recipes to different demands. Finally, an acrylic fiber production example is presented to illustrate process development decisions like the selection of tasks, technological alternatives, chemicals, and solvent reuse.La indústria de productes químics especials es basa en la fabricació discontinua, ja que permet adaptar de forma freqüent els sistemes de producció en funció de les fluctuacions de mercat. Per ser líder al sector, són necessàries eines de suport a la decisió que ajudin a l’àgil desenvolupament i implementació de nous processos. A més, aquests han de ser competitius per garantir la seva viabilitat a llarg termini. Altres peces clau per una operació eficient són l’ús de plantes flexibles així com l’estudi dels fenòmens fisicoquímics. Aquesta tesis aborda justament el desenvolupament sistemàtic de processos químics discontinus que siguin eficients, econòmicament competitius i ecològics, per contribuir a la seva ràpida introducció en els sistemes de producció, tant en escenaris de plantes existents com des de les bases. En concret, es planteja la resolució simultània de la síntesi conceptual d’esquemes de procés i l’assignació d’equips, tenint en compte el disseny de la planta. Amb aquest objectiu, es proposa una metodologia de solució basada en optimització, on les alternatives estructurals es representen en una Xarxa d’Estats i Equips (SEN per les sigles en anglès) que es formula mitjançant un problema d’Optimització Dinàmica Mixta-Lògica (MLDO per les sigles en anglès) que es resol minimitzant una funció objectiu. La solidesa de la metodologia proposada rau en la estratègia de modelat del problema MLDO, que integra els diferents tipus de decisions en un sol model d’optimització. En concret, es consideren: (i) la combinació d’alternatives de síntesi i assignació d’equips, (ii) models de procés i trajectòries de control dinàmics, (iii) esdeveniments discrets associats al canvi de fase i operació, (iv) informació quantitativa i qualitativa, (v) sincronització de transferències de material en tasques consecutives, i (vi) elements de processat discontinus i semi-continus. Existeixen diverses estratègies per resoldre el problema MLDO resultant. En aquesta tesi es proposa en primer lloc un mètode determinístic directe-simultani, on el model mixt-lògic es transforma en un mixt-enter. Aquest es discretitza al seu torn de forma completa per obtenir un problema de Programació No-Lineal Mixta-Entera (MINLP per les sigles en anglès) el qual es pot resoldre utilitzant algoritmes d’optimització convencionals. A més, es presenten un Algoritme Genètic Diferencial (DGA per les sigles en anglès) i un mètode híbrid. Totes dues estratègies esdevenen alternatives de cerca amb l’objectiu de mantenir la bondat de la solució i millorar l’eficàcia de computació per tractar problemes de dimensió industrial. La metodologia de solució proposada s’aplica al desenvolupament de processos discontinus en escenaris de plantes existents, tenint en compte les restriccions físiques dels equips. Un primer exemple aborda la manufactura de productes químics basada en un sistema de reaccions competitives. Concretament, es desenvolupa i millora el procés de producció implementat en una xarxa de reactors considerant diferents escenaris econòmics, criteris de decisió, i modificacions de planta. En un segon exemple, s’optimitza el procés foto-Fenton per ser executat en una planta pilot per eliminar contaminants emergents. Buscant integrar el desenvolupament de procés i el disseny de plantes flexibles en escenaris de base, es presenta una formulació estocàstica en dues etapes per a optimitzar el benefici esperat d’acord a diversos escenaris de demanda. Per gestionar la complexitat d’aquest problema es proposa la utilització d’una heurística. Com a exemple, es planteja el disseny d’una planta de base on implementar l’anterior sistema de reaccions competitives. Decisions com les trajectòries dinàmiques de control o la configuració d’equips permeten adaptar la recepta màster en funció de la demanda. Un darrer exemple defineix el procés de producció de fibra acrílica, il·lustrant decisions com la selecció de tasques, tecnologia, reactius o reutilització de dissolvents.La industria productos químicos especiales se basa en la fabricación discontinua, la cual permite la adaptación frecuente de los sistemas de producción en función de las fluctuaciones de mercado. Para ser líder en el sector, son necesarias herramientas de soporte a la decisión que contribuyan al ágil desarrollo e implementación de nuevos procesos. Además, éstos deben ser competitivos para garantizar su viabilidad a largo plazo. Otras piezas clave para una operación eficiente son la utilización de plantas flexibles y el estudio de los fenómenos fisicoquímicos. Esta tesis aborda justamente el desarrollo sistemático de procesos químicos discontinuos que sean eficientes, económicamente competitivos y ecológicos, para contribuir a su rápida introducción en los sistemas de producción, ya sea en escenarios de plantas existentes o desde las bases. En particular, se plantea la resoluciónsimultánea de la síntesis conceptual de esquemas de proceso y la asignación de equipos, teniendo en cuenta además el diseño de planta.Con este fin, se propone una metodología de solución basada en optimización, donde todas las alternativas estructurales se representan en una Red de Estados y Equipos (SENpor sus siglas en inglés) que se formula mediante un problema de Optimización Dinámica Mixta-Lógica (MLDO por sus siglas en inglés) que se resuelve minimizando una función objetivo. La solidez de la metodología propuesta reside en la estrategia de modelado delproblema MLDO, que integra los diferentes tipos de decisiones en un solo modelo de optimización. En concreto, se consideran: (i) la combinación de alternativas de síntesis y asignación de equipos, (ii) modelos de proceso y trayectorias de control dinámicos, (iii)eventos discretos asociados al cambio de fase y operación, (iv) información cuantitativa y cualitativa, (v) sincronización de la transferencia de material en tareas consecutivas, y(vi) elementos de procesado discontinuos y semicontinuos.Existen diversas estrategias para resolver el problema MLDO resultante. En esta tesis se propone en primer lugar un método determinístico directo-simultáneo, donde el problema mixto-lógico se reformula en un mixto-entero. A su vez, éste se discretiza de formacompleta para obtener un problema de Programación No-Lineal Mixta-Entera (MINLP por sus siglas en inglés) el cual se puede resolver mediante algoritmos de optimización convencionales. Además, se presentan un Algoritmo Genético Diferencial (DGA por sussiglas en inglés) y un método híbrido. Ambas estrategias se plantean como alternativas de búsqueda con objeto de mantener la bondad de la solución y mejorar la eficacia de computación para tratar problemas de dimensión industrial.La metodología de solución propuesta se aplica al desarrollo de procesos discontinuos en escenarios con plantas existentes, teniendo en cuenta las restricciones físicas de los equipos. Un primer ejemplo aborda la fabricación de productos químicos basada en un sistema de reacciones competitivas. En concreto, se desarrolla y mejora el proceso de producción a implementar en una red de reactores considerando diferentes escenarios económicos, criterios de decisión, y modificaciones de planta. En un segundo ejemplo,se optimiza el proceso foto-Fenton a ser ejecutado en una planta piloto para eliminar contaminantes emergentes.Persiguiendo la integración del desarrollo de proceso con el diseño de plantas flexi-bles en escenarios base, se presenta asimismo una formulación estocástica en dos etapas para optimizar el beneficio esperado de acuerdo a varios escenarios de demanda. Paramanejar la complejidad de dicho problema se propone la utilización de una heurística.Como ejemplo, se plantea el diseño de una planta de base para implementar el anterior sistema de reacciones competitivas, donde decisiones como las trayectorias dinámicas de control o la configuración de equipos permiten adaptar la receta máster en función de lademandas. Por último, se presenta un ejemplo donde se define el proceso de producción de fibra acrílica, ilustrando decisiones como la selección de tareas, alternativas tecnológicas, reactivos químicos o la reutilización de disolventes.Postprint (published version

Wastewater minimization in multipurpose batch processes using mathematical modelling

A dissertation submitted to the Faculty of Engineering and the Built Environment, University of the Witwatersrand, in fulfillment of the requirements for the degree of Master of Science in Engineering May 2018The increase in the degradation of water sources and stringent environmental regulations have greatly motivated industries to explore means of utilizing water efficiently. Batch processes are known to generate highly contaminated wastewater that is toxic to the environment. A holistic approach to design which emphasizes the unity of the process, process integration (PI), can be used to reduce both the wastewater generated and the level of contamination while maintaining the profitability of the chemical plant. Process integration techniques for wastewater minimization in batch processes include water reuse, recycle and regeneration. Most mathematical formulations for wastewater minimization in multipurpose batch processes presented in literature determine the amount of water required for washing operations by only looking at the task that has just occurred in a unit. However, the nature of the succeeding task can influence the amount of water required for the washing operation between consecutive tasks in a processing unit. In paint manufacturing, for example, more water will be required for the washing operation if the production of white paint follows the production of black paint and less water will be required if the black paint follows the white paint. The amount of wastewater generated in batch processes can, therefore, be reduced by simply synthesizing a sequence of tasks that will generate the least amount of wastewater. Presented in this work are wastewater minimization formulations for multipurpose batch processes which explore sequence dependent changeover opportunities for water minimization simultaneously with direct and indirect water reuse and recycle opportunities. The presence of continuous and integer variables, as well as bilinear terms, rendered the model a Mixed Integer Nonlinear Program (MINLP). The developed MINLP model was validated using two single contaminant illustrative examples and a multiple contaminant example. A global optimization solver, Branch and Reduce Optimization Navigator (BARON), was used to solve the optimization problems on a General Algebraic Modeling System (GAMS) platform. Exploring multiple water saving opportunities simultaneously has proven to be computationally intensive but can result in significant water savings. For instance, two different scenarios saved 65% and 61% in freshwater use respectively.MT 201

Decision makings in key remanufacturing activities to optimise remanufacturing outcomes : a review

The importance of remanufacturing has been increasing since stricter regulations on protecting the environment were enforced. Remanufacturing is considered as the main means of retaining value from used products and components in order to drive a circular economy. However, it is more complex than traditional manufacturing due to the uncertainties associated with the quality, quantities and return timing of used products and components. Over the past few years, various methods of optimising remanufacturing outcomes have been developed to make decisions such as identifying the best End-Of-Life (EOL) options, acquiring the right amounts of cores, deciding the most suitable disassembly level, applying suitable cleaning techniques, and considering product commonality across different product families. A decision being made at one remanufacturing activity will greatly affect the decisions at subsequent activities, which will affect remanufacturing outcomes, i.e. productivity, economic performance effectiveness, and the proportion of core that can be salvaged. Therefore, a holistic way of integrating different decisions over multiple remanufacturing activities is needed to improve remanufacturing outcomes, which is a major knowledge gap. This paper reviews current remanufacturing practice in order to highlight both the challenges and opportunities, and more importantly, offers useful insights on how such a knowledge gap can be bridged

Green supply chain quantitative models for sustainable inventory management: A review

[EN] This paper provides a systematic and up-to-date review and classification of 91 studies on quantitative methods of green supply chains for sustainable inventory management. It particularly identifies the main study areas, findings and quantitative models by setting a point for future research opportunities in sustainable inventory management. It seeks to review the quantitative methods that can better contribute to deal with the environmental impact challenge. More specifically, it focuses on different supply chain designs (green supply chain, sustainable supply chain, reverse logistics, closed-loop supply chain) in a broader application context. It also identifies the most important variables and parameters in inventory modelling from a sustainable perspective. The paper also includes a comparative analysis of the different mathematical programming, simulation and statistical models, and their solution approach, with exact methods, simulation, heuristic or meta-heuristic solution algorithms, the last of which indicate the increasing attention paid by researchers in recent years. The main findings recognise mixed integer linear programming models supported by heuristic and metaheuristic algorithms as the most widely used modelling approach. Minimisation of costs and greenhouse gas emissions are the main objectives of the reviewed approaches, while social aspects are hardly addressed. The main contemplated inventory management parameters are holding costs, quantity to order, safety stock and backorders. Demand is the most frequently shared information. Finally, tactical decisions, as opposed to strategical and operational decisions, are the main ones.The research leading to these results received funding from the Grant RTI2018-101344-B-I00 funded by MCIN/AEI/10.13039/501100011033 and by "ERDF A way of making Europe". It was also funded by the National Agency for Research and Development (ANID) / Scholarship Program/Doctorado Becas en el Extranjero/2020 72210174.Becerra, P.; Mula, J.; Sanchis, R. (2021). Green supply chain quantitative models for sustainable inventory management: A review. Journal of Cleaner Production. 328:1-16. https://doi.org/10.1016/j.jclepro.2021.129544S11632

Operational Research IO2017, Valença, Portugal, June 28-30

This proceedings book presents selected contributions from the XVIII Congress of APDIO (the Portuguese Association of Operational Research) held in Valença on June 28–30, 2017. Prepared by leading Portuguese and international researchers in the field of operations research, it covers a wide range of complex real-world applications of operations research methods using recent theoretical techniques, in order to narrow the gap between academic research and practical applications. Of particular interest are the applications of, nonlinear and mixed-integer programming, data envelopment analysis, clustering techniques, hybrid heuristics, supply chain management, and lot sizing and job scheduling problems. In most chapters, the problems, methods and methodologies described are complemented by supporting figures, tables and algorithms. The XVIII Congress of APDIO marked the 18th installment of the regular biannual meetings of APDIO – the Portuguese Association of Operational Research. The meetings bring together researchers, scholars and practitioners, as well as MSc and PhD students, working in the field of operations research to present and discuss their latest works. The main theme of the latest meeting was Operational Research Pro Bono. Given the breadth of topics covered, the book offers a valuable resource for all researchers, students and practitioners interested in the latest trends in this field.info:eu-repo/semantics/publishedVersio