Mathematical modeling of production and biorefinery of energy crops

Mathematical models have been widely used to simulate all aspects of bioenergy production systems including the growth kinetics of energy crops, conversion processes, production economics, supply logistics and environmental impacts. There is limited commercial experience to produce and process energy crops at a large scale around the world. Those models can provide powerful tools to design a bioenergy system and evaluate its technical feasibility, economics and environmental impacts. A crop growth model can be used to estimate the yields of energy crops in a region under different growth conditions. A geographical information system (GIS) model can be used to maximize the energy production of energy crops by indentifying suitable land to grow them based on their specific characteristics and the current use of the land. A combination of process models and reaction kinetics provides advanced computational tools for the design and optimization of various biomass conversion processes. The biomass supply chain consists of multiple harvesting, storage, pre-processing and transport options. Mathematical models have been developed to analyze and optimize complex biomass supply systems. A life cycle assessment (LCA) model can be used to compare the environmental impacts of different biomass production and conversion technologies. Various mathematical models applied to bioenergy systems were reviewed. The challenges in mathematical modeling of bioenergy systems which include the difficulty in generalizing a bioenergy system, the lack of physical and chemical properties of various biomass, the complexity of multi-scale processes and the validation of the models were then discussed.

[1]  Scott C. James,et al.  Modeling Algae Growth in an Open-Channel Raceway , 2008, J. Comput. Biol..

[2]  Hans-Jürgen Dr. Klüppel,et al.  The Revision of ISO Standards 14040-3 - ISO 14040: Environmental management – Life cycle assessment – Principles and framework - ISO 14044: Environmental management – Life cycle assessment – Requirements and guidelines , 2005 .

[3]  Dingena L. Schott,et al.  Physical properties of solid biomass , 2011 .

[4]  N. Mahinpey,et al.  Simulation of biomass gasification in fluidized bed reactor using ASPEN PLUS. , 2008 .

[5]  Muthanna H. Al-Dahhan,et al.  Verification and validation of CFD simulations for local flow dynamics in a draft tube airlift bioreactor , 2011 .

[6]  Mahmoud M El-Halwagi,et al.  Techno-economic analysis for a sugarcane biorefinery: Colombian case. , 2013, Bioresource technology.

[7]  Jhuma Sadhukhan,et al.  Process integration and economic analysis of bio-oil platform for the production of methanol and combined heat and power , 2011 .

[8]  A. Concas,et al.  Novel simulation model of the solar collector of BIOCOIL photobioreactors for CO2 sequestration with microalgae , 2010 .

[9]  L. Lardon,et al.  Life-cycle assessment of microalgae culture coupled to biogas production. , 2011, Bioresource technology.

[10]  D. Hempel,et al.  Liquid flow and phase holdup—measurement and CFD modeling for two-and three-phase bubble columns , 2002 .

[11]  Xiaoxi Wu,et al.  Simulation of algae growth in a bench-scale bubble column reactor. , 2002, Biotechnology and bioengineering.

[12]  J. Heijnen,et al.  Metabolic-flux analysis of Saccharomyces cerevisiae CEN.PK113-7D based on mass isotopomer measurements of (13)C-labeled primary metabolites. , 2005, FEMS yeast research.

[13]  Ronghou Liu,et al.  Kinetics of Batch Fermentations for Ethanol Production with Immobilized Saccharomyces cerevisiae Growing on Sweet Sorghum Stalk Juice , 2012 .

[14]  M. D. Souza-Santos Comprehensive modelling and simulation of fluidized bed boilers and gasifiers , 1989 .

[15]  Binxin Wu,et al.  CFD investigation of turbulence models for mechanical agitation of non-Newtonian fluids in anaerobic digesters. , 2011, Water research.

[16]  K. Heek,et al.  Kinetic studies of steam gasification of char in the presence of H2, CO2 and CO , 1985 .

[17]  Pradeep K. Agarwal,et al.  The COCO2 product ratio for a porous char particle within an incipiently fluidized bed: a numerical study , 1997 .

[18]  Hyohak Song,et al.  Modeling of batch experimental kinetics and application to fed-batch fermentation of Clostridium tyrobutyricum for enhanced butyric acid production. , 2010 .

[19]  M. Galbe,et al.  Techno-Economic Evaluation of Bioethanol Production from Three Different Lignocellulosic Materials , 2008 .

[20]  Ivonete Ávila,et al.  Prediction of the combustion process in fluidized bed based on physical-chemical properties of biomass particles and their hydrodynamic behaviors , 2014 .

[21]  Danny Lathouwers,et al.  MODELING OF BIOMASS PYROLYSIS FOR HYDROGEN PRODUCTION: THE FLUIDIZED BED REACTOR , 2001 .

[22]  A. Ashraf,et al.  Simulation of hybrid biomass gasification using Aspen plus: A comparative performance analysis for food, municipal solid and poultry waste , 2011 .

[23]  P. Geladi,et al.  Biomass properties in association with plant species and assortments I: A synthesis based on literature data of energy properties , 2012 .

[24]  K. Craig,et al.  CFD simulation of anaerobic digester with variable sewage sludge rheology. , 2013, Water research.

[25]  P. Basu Combustion and gasification in fluidized beds , 2006 .

[26]  Stephen Niksa,et al.  Predicting the rapid devolatilization of diverse forms of biomass with bio-flashchain , 2000 .

[27]  David A. Mitchell,et al.  A review of recent developments in modeling of microbial growth kinetics and intraparticle phenomena in solid-state fermentation , 2004 .

[28]  Giorgio Guariso,et al.  A GIS-based approach to evaluate biomass potential from energy crops at regional scale , 2010, Environ. Model. Softw..

[29]  Robert N Meroney,et al.  CFD simulation of mechanical draft tube mixing in anaerobic digester tanks. , 2009, Water research.

[30]  Hsien Hui Khoo,et al.  Food waste conversion options in Singapore: environmental impacts based on an LCA perspective. , 2010, The Science of the total environment.

[31]  Huajiang Huang,et al.  Effect of biomass species and plant size on cellulosic ethanol: A comparative process and economic analysis , 2009 .

[32]  Jonathan Moncada,et al.  Techno-economic analysis of bioethanol production from lignocellulosic residues in Colombia: a process simulation approach. , 2013, Bioresource technology.

[33]  Johann C. Wurzenberger,et al.  Thermal conversion of biomass: Comprehensive reactor and particle modeling , 2002 .

[34]  Lijun Wang,et al.  Sustainable bioenergy production , 2014 .

[35]  Sai Gu,et al.  A CFD approach on the effect of particle size on char entrainment in bubbling fluidised bed reactors , 2010 .

[36]  A. Bridgwater,et al.  CFD modelling of the fast pyrolysis of biomass in fluidised bed reactors, Part A: Eulerian computation of momentum transport in bubbling fluidised beds , 2008 .

[37]  Qiang Lu,et al.  Catalytic upgrading of biomass fast pyrolysis vapors with titania and zirconia/titania based catalysts , 2010 .

[38]  Binxin Wu,et al.  CFD simulation of gas and non-Newtonian fluid two-phase flow in anaerobic digesters. , 2010, Water research.

[39]  Weeratunge Malalasekera,et al.  An introduction to computational fluid dynamics - the finite volume method , 2007 .

[40]  Yiqun Wang,et al.  CFD Studies on Biomass Thermochemical Conversion , 2008, International journal of molecular sciences.

[41]  Suzana Yusup,et al.  Mathematical and computational approaches for design of biomass gasification for hydrogen production: A review , 2012 .

[42]  Tiziano Faravelli,et al.  Chemical Kinetics of Biomass Pyrolysis , 2008 .

[43]  George N. Bennett,et al.  Metabolic Flux Analysis ofEscherichia coliDeficient in the Acetate Production Pathway and Expressing theBacillus subtilisAcetolactate Synthase , 1999 .

[44]  Il-Hwan Seo,et al.  Review: Application of computational fluid dynamics for modeling and designing photobioreactors for microalgae production: A review , 2011 .

[45]  Binxin Wu,et al.  Advances in the use of CFD to characterize, design and optimize bioenergy systems , 2013 .

[46]  Jianbang Gan,et al.  Optimal plant size and feedstock supply radius: A modeling approach to minimize bioenergy production costs , 2011 .

[47]  Andrea Corti,et al.  Biomass integrated gasification combined cycle with reduced CO2 emissions: Performance analysis and life cycle assessment (LCA) , 2004 .

[48]  Petar Liovic,et al.  Comparing the energy efficiency of different high rate algal raceway pond designs using computational fluid dynamics , 2013 .

[49]  T Fruergaard,et al.  Optimal utilization of waste-to-energy in an LCA perspective. , 2011, Waste management.

[50]  G. J. Germane,et al.  Char oxidation at elevated pressures , 1995 .

[51]  Alvaro Sanz,et al.  Modeling circulating fluidized bed biomass gasifiers. A pseudo-rigorous model for stationary state , 2005 .

[52]  Jun Zhang,et al.  An integrated optimization model for switchgrass-based bioethanol supply chain , 2013 .

[53]  John R. Grace,et al.  Verification and validation of CFD models and dynamic similarity for fluidized beds , 2004 .

[54]  R. Singh,et al.  CFD modeling to study fluidized bed combustion and gasification , 2013 .

[55]  Binxin Wu,et al.  CFD simulation of non‐Newtonian fluid flow in anaerobic digesters , 2008, Biotechnology and bioengineering.

[56]  Francesco Cherubini,et al.  Energy- and greenhouse gas-based LCA of biofuel and bioenergy systems: Key issues, ranges and recommendations , 2009 .

[57]  K. Sand‐Jensen,et al.  Size-dependent nitrogen uptake in micro- and macroalgae , 1995 .

[58]  Kelly N. Ibsen,et al.  Lignocellulosic Biomass to Ethanol Process Design and Economics Utilizing Co-Current Dilute Acid Prehydrolysis and Enzymatic Hydrolysis for Corn Stover , 2002 .

[59]  Tom Van Gerven,et al.  Hydrodynamic evaluations in high rate algae pond (HRAP) design , 2013 .

[60]  C. Gasol,et al.  Environmental assessment: (LCA) and spatial modelling (GIS) of energy crop implementation on local scale , 2011 .

[61]  Jalel Labidi,et al.  Energy and Economic Assessment of Soda and Organosolv Biorefinery Processes , 2010 .

[62]  Jam Hans Kuipers,et al.  Critical comparison of hydrodynamic models for gas-solid fluidized beds - Part I: bubbling gas-solid fludized beds operated with a jet , 2005 .

[63]  Kazuyuki Shimizu,et al.  Quantitative analysis of intracellular metabolic fluxes using GC-MS and two-dimensional NMR spectroscopy. , 2002, Journal of bioscience and bioengineering.

[64]  Yusuf Chisti,et al.  Bubble‐column and airlift photobioreactors for algal culture , 2000 .

[65]  Yang Kuang,et al.  Growth and neutral lipid synthesis in green microalgae: a mathematical model. , 2011, Bioresource technology.

[66]  K van't Riet,et al.  Modeling of bacterial growth as a function of temperature , 1991, Applied and environmental microbiology.

[67]  Pierre Proulx,et al.  Two-phase mass transfer coefficient prediction in stirred vessel with a CFD model , 2008, Comput. Chem. Eng..

[68]  Michele Aresta,et al.  Utilization of macro-algae for enhanced CO2 fixation and biofuels production: Development of a computing software for an LCA study , 2005 .

[69]  A. Zabaniotou,et al.  Mathematical modelling and simulation approaches of agricultural residues air gasification in a bubbling fluidized bed reactor , 2008 .

[70]  Andrea Corti,et al.  Life cycle assessment (LCA) of an integrated biomass gasification combined cycle IBGCC with CO2 removal , 2005 .

[71]  R. Luedeking,et al.  A kinetic study of the lactic acid fermentation. Batch process at controlled pH , 2000 .

[72]  Andreja Goršek,et al.  Modelling of batch kefir fermentation kinetics for ethanol production by mixed natural microflora , 2010 .

[73]  Jie Ding,et al.  A hydrodynamics-reaction kinetics coupled model for evaluating bioreactors derived from CFD simulation. , 2010, Bioresource technology.

[74]  Colomba Di Blasi,et al.  Modeling chemical and physical processes of wood and biomass pyrolysis , 2008 .

[75]  A. Gómez-Barea,et al.  Modeling of biomass gasification in fluidized bed , 2010 .

[76]  G. I. Barenblatt Scaling: Self-similarity and intermediate asymptotics , 1996 .

[77]  Curtis L. Weller,et al.  A MATHEMATICAL MODEL FOR THE VALIDATION OF SAFE AIR-BLAST CHILLING OF COOKED HAMS , 2006 .

[78]  J. Bridgeman,et al.  Computational fluid dynamics modelling of sewage sludge mixing in an anaerobic digester , 2012, Adv. Eng. Softw..

[79]  Mark A. White,et al.  Environmental life cycle comparison of algae to other bioenergy feedstocks. , 2010, Environmental science & technology.

[80]  Paul Monis,et al.  Metabolic flux network and analysis of fermentative hydrogen production. , 2011, Biotechnology advances.

[81]  Carl Johan Franzén,et al.  Metabolic flux analysis of RQ‐controlled microaerobic ethanol production by Saccharomyces cerevisiae , 2003, Yeast.

[82]  Thomas Kätterer,et al.  Winter wheat biomass and nitrogen dynamics under different fertilization and water regimes: application of a crop growth model , 1997 .

[83]  Sergio Ulgiati,et al.  Assessing the environmental performance and sustainability of bioenergy production in Sweden: A life cycle assessment perspective , 2012 .

[84]  Tristan R. Brown,et al.  Techno-economic analysis of monosaccharide production via fast pyrolysis of lignocellulose. , 2013, Bioresource technology.

[85]  Wim Turkenburg,et al.  The energy crop growth model SILVA: Description and application to Eucalyptus plantations in Nicaragua. , 2001 .

[86]  Kai Zhang,et al.  Optimized aeration by carbon dioxide gas for microalgal production and mass transfer characterization in a vertical flat-plate photobioreactor , 2002, Bioprocess and biosystems engineering.

[87]  Hiroshi Takahashi,et al.  CFD simulation of mixing in anaerobic digesters. , 2009, Bioresource technology.

[88]  Muthanna Al-Dahhan,et al.  Flow pattern visualization in a mimic anaerobic digester using CFD. , 2005, Biotechnology and bioengineering.

[89]  Shahab Sokhansanj,et al.  Switchgrass (Panicum vigratum, L.) delivery to a biorefinery using integrated biomass supply analysis and logistics (IBSAL) model. , 2007, Bioresource technology.

[90]  Tao Wu,et al.  Relationship between thermal behaviour of lignocellulosic components and properties of biomass. , 2014, Bioresource technology.

[91]  A. Aden,et al.  Process Design Report for Stover Feedstock: Lignocellulosic Biomass to Ethanol Process Design and Economics Utilizing Co-Current Dilute Acid Prehydrolysis and Enzymatic Hydrolysis for Corn Stover , 2002 .

[92]  Sven Lundie,et al.  LIFE CYCLE ASSESSMENT OF FOOD WASTE MANAGEMENT OPTIONS , 2005 .

[93]  R. Vance Morey,et al.  Aspen Plus simulation of biomass integrated gasification combined cycle systems at corn ethanol plants , 2013 .

[94]  Serafim D. Vlaev,et al.  A Simplified CFD for Three-dimensional Analysis of Fluid Mixing, Mass Transfer and Bioreaction in a Fermenter Equipped with Triple Novel Geometry Impellers , 2004 .

[95]  Siegmar Wirtz,et al.  Numerical simulation of grate firing systems using a coupled CFD/discrete element method (DEM) , 2009 .

[96]  Binxin Wu,et al.  CFD simulation of mixing in egg-shaped anaerobic digesters. , 2010, Water research.

[97]  Colomba Di Blasi,et al.  Combustion and gasification rates of lignocellulosic chars , 2009 .

[98]  Pio Forzatti,et al.  Mathematical modelling of catalytic combustors fuelled by gasified biomasses , 2000 .

[99]  Anders Roos,et al.  The limits of modelling. Experiences with bioenergy in practice — could models have predicted this outcome? , 2000 .