Applied mathematics and modeling for chemical engineers

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Hauptverfasser: Rice, Richard G. (VerfasserIn), Do, Duong D. (VerfasserIn)
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Sprache:English
Veröffentlicht: Hoboken, NJ Wiley 2012
Ausgabe:2. ed.
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Datensatz im Suchindex

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adam_text CONTENTS Preface to the Second Edition xi PARTI 1 Formulation of Physicochemical Problems 1.1 Introduction, 3 1.2 Illustration of the Formulation Process (Cooling of Fluids), 3 1.2.1 Model I: Plug Row, 3 1.2.2 Model II: Parabolic Velocity, 6 1.3 Combining Rate and Equilibrium Concepts (Packed Bed Adsorber), 7 1.4 Boundary Conditions and Sign Conventions, 8 1.5 Models with Many Variables: Vectors and Matrices, 10 1.6 Matrix Definition, 10 1.6.1 The Matrix, 10 1.6.2 The Vector, 11 1.7 Types of Matrices, 11 1.7.1 Square Matrix, 11 1.7.2 Diagonal Matrix, 11 1.7.3 Triangular Matrix, 11 1.7.4 Tridiagonal Matrix, 11 1.7.5 Symmetric Matrix, 11 1.7.6 Sparse Matrix, 11 1.7.7 Diagonally Dominant Matrix, 11 1.8 Matrix Algebra, 12 1.8.1 Addition and Subtraction, 12 1.8.2 Multiplication, 12 1.8.3 Inverse, 12 1.8.4 Matrix Decomposition or Factorization, 13 1.9 Useful Row Operations, 13 1.9.1 Scaling, 13 1.9.2 Pivoting, 13 1.9.3 Elimination, 13 1.10 Direct Elimination Methods, 14 vi CONTENTS 1.10.1 Basic Procedure, 14 1.10.2 Augmented Matrix, 14 1.10.3 Pivoting, 15 1.10.4 Scaling, 16 1.10.5 Gauss Elimination, 16 1.10.6 Gauss-Jordan Elimination: Solving Linear Equations, 17 1.10.7 LU Decomposition, 17 1.11 Iterative Methods, 18 1.11.1 Jacobi Method, 18 1.11.2 Gauss-Seidel Iteration Method, 18 1.11.3 Successive Overrelaxation Method, 18 1.12 Summary of the Model Building Process, 19 1.13 Model Hierarchy and its Importance in Analysis, 19 Problems, 25 References, 30 2 Solution Techniques for Models Yielding Ordinary Differential Equations 31 2.1 Geometric Basis and Functionality, 31 2.2 Classification of ODE, 32 2.3 First-Order Equations, 32 2.3.1 Exact Solutions, 33 2.3.2 Equations Composed of Homogeneous Functions, 34 2.3.3 Bernoulli s Equation, 34 2.3.4 Riccati s Equation, 35 2.3.5 Linear Coefficients, 36 2.3.6 First-Order Equations of Second Degree, 37 2.4 Solution Methods for Second-Order Nonlinear Equations, 37 2.4.1 Derivative Substitution Method, 38 2.4.2 Homogeneous Function Method, 41 2.5 Linear Equations of Higher Order, 42 2.5.1 Second-Order Unforced Equations: Complementary Solutions, 43 2.5.2 Particular Solution Methods for Forced Equations, 47 2.5.3 Summary of Particular Solution Methods, 55 2.6 Coupled Simultaneous ODE, 55 2.7 Eigenproblems, 59 2.8 Coupled Linear Differential Equations, 59 2.9 Summary of Solution Methods for ODE, 60 Problems, 60 References, 73 3 Series Solution Methods and Special Functions 75 3.1 Introduction to Series Methods, 75 3.2 Properties of Infinite Series, 76 3.3 Method of Frobenius, 77 3.3.1 Indiciai Equation and Recurrence Relation, 77 3.4 Summary of the Frobenius Method, 85 3.5 Special Functions, 86 3.5.1 Besseľs Equation, 86 3.5.2 Modified Besseľ s Equation, 87 3.5.3 Generalized Bessel s Equation, 88 3.5.4 Properties of Bessel Functions, 89 3.5.5 Differential, Integral, and Recurrence Relations, 91 CONTENTS Problems, 93 References, 95 4 Integral Functions 97 4.1 Introduction, 97 4.2 The Error Function, 97 4.2.1 Properties of Error Function, 97 4.3 The Gamma and Beta Functions, 98 4.3.1 The Gamma Function, 98 4.3.2 The Beta Function, 99 4.4 The Elliptic Integrals, 99 4.5 The Exponential and Trigonometric Integrals, 101 Problems, 102 References, 104 5 Staged-Process Models: The Calculus of Finite Differences 105 5.1 Introduction, 105 5.1.1 Modeling Multiple Stages, 105 5.2 Solution Methods for Linear Finite Difference Equations, 106 5.2.1 Complementary Solutions, 106 5.3 Particular Solution Methods, 109 5.3.1 Method of Undetermined Coefficients, 109 5.3.2 Inverse Operator Method, 110 5.4 Nonlinear Equations (Riccati Equation), 111 Problems, 112 References, 115 6 Approximate Solution Methods for ODE: Perturbation Methods 117 6.1 Perturbation Methods, 117 6.1.1 Introduction, 117 6.2 The Basic Concepts, 120 6.2.1 Gauge Functions, 120 6.2.2 Order Symbols, 120 6.2.3 Asymptotic Expansions and Sequences, 120 6.2.4 Sources of Nonuniformity, 121 6.3 The Method of Matched Asymptotic Expansion, 122 6.3.1 Outer Solutions, 123 6.3.2 Inner Solutions, 123 6.3.3 Matching, 124 6.3.4 Composite Solutions, 124 6.3.5 General Matching Principle, 124 6.3.6 Composite Solution of Higher Order, 125 6.4 Matched Asymptotic Expansions for Coupled Equations, 125 6.4.1 Outer Expansion, 126 6.4.2 Inner Expansion, 126 6.4.3 Matching, 127 Problems, 128 References, 136 viii CONTENTS PART II 137 7 Numerical Solution Methods (Initial Value Problems) 139 7.1 Introduction, 139 7.2 Type of Method, 142 7.3 Stability, 142 7.4 Stiffness, 147 7.5 Interpolation and Quadrature, 149 7.6 Explicit Integration Methods, 150 7.7 Implicit Integration Methods, 152 7.8 Predictor-Corrector Methods and Runge-Kutta Methods, 152 7.8.1 Predictor-Corrector Methods, 152 7.9 Runge-Kutta Methods, 153 7.10 Extrapolation, 155 7.11 Step Size Control, 155 7.12 Higher Order Integration Methods, 156 Problems, 156 References, 159 8 Approximate Methods for Boundary Value Problems: Weighted Residuals 161 8.1 The Method of Weighted Residuals, 161 8.1.1 Variations on a Theme of Weighted Residuals, 162 8.2 Jacobi Polynomials, 170 8.2.1 Rodrigues Formula, 170 8.2.2 Orthogonality Conditions, 170 8.3 Lagrange Interpolation Polynomials, 172 8.4 Orthogonal Collocation Method, 172 8.4.1 Differentiation of a Lagrange Interpolation Polynomial, 172 8.4.2 Gauss-Jacobi Quadrature, 173 8.4.3 Radau and Lobatto Quadrature, 175 8.5 Linear Boundary Value Problem: Dirichlet Boundary Condition, 175 8.6 Linear Boundary Value Problem: Robin Boundary Condition, 177 8.7 Nonlinear Boundary Value Problem: Dirichlet Boundary Condition, 179 8.8 One-Point Collocation, 181 8.9 Summary of Collocation Methods, 182 8.10 Concluding Remarks, 183 Problems, 184 References, 192 9 Introduction to Complex Variables and Laplace Transforms 193 9.1 Introduction, 193 9.2 Elements of Complex Variables, 193 9.3 Elementary Functions of Complex Variables, 194 9.4 Multivalued Functions, 195 9.5 Continuity Properties for Complex Variables: Analyticity, 196 9.5.1 Exploiting Singularities, 198 9.6 Integration: Cauchy s Theorem, 198 9.7 Cauchy s Theory of Residues, 200 9.7.1 Practical Evaluation of Residues, 201 9.7.2 Residues at Multiple Poles, 202 CONTENTS 9.8 Inversion of Laplace Transforms by Contour Integration, 202 9.8.1 Summary of Inversion Theorem for Pole Singularities, 204 9.9 Laplace Transformations: Building Blocks, 204 9.9.1 Taking the Transform, 204 9.9.2 Transforms of Derivatives and Integrals, 206 9.9.3 The Shifting Theorem, 207 9.9.4 Transform of Distribution Functions, 207 9.10 Practical Inversion Methods, 209 9.10.1 Partial Fractions, 209 9.10.2 Convolution Theorem, 210 9.11 Applications of Laplace Transforms for Solutions of ODE, 211 9.12 Inversion Theory for Multivalued Functions: the Second Bromwich Path, 215 9.12.1 Inversion When Poles and Branch Points Exist, 218 9.13 Numerical Inversion Techniques, 218 9.13.1 The Zakian Method, 218 9.13.2 The Fourier Series Approximation, 220 Problems, 221 References, 225 10 Solution Techniques for Models Producing PDEs 227 10.1 Introduction, 227 10.1.1 Classification and Characteristics of Linear Equations, 229 10.2 Particular Solutions for PDEs, 231 10.2.1 Boundary and Initial Conditions, 231 10.3 Combination of Variables Method, 233 10.4 Separation of Variables Method, 238 10.4.1 Coated Wall Reactor, 238 10.5 Orthogonal Functions and Sturm-Liouville Conditions, 241 10.5.1 The Sturm-Liouville Equation, 241 10.6 Inhomogeneous Equations, 245 10.7 Applications of Laplace Transforms for Solutions of PDEs, 248 Problems, 254 References, 271 11 Transform Methods for Linear PDEs 273 11.1 Introduction, 273 11.2 Transforms in Finite Domain: Sturm-Liouville Transforms, 273 11.2.1 Development of Integral Transform Pairs, 274 11.2.2 The Eigenvalue Problem and the Orthogonality Condition, 277 11.2.3 Inhomogeneous Boundary Conditions, 282 11.2.4 Inhomogeneous Equations, 285 11.2.5 Time-Dependent Boundary Conditions, 286 11.2.6 Elliptic Partial Differential Equations, 287 11.3 Generalized Sturm-Liouville Integral Transform, 289 11.3.1 Introduction, 289 11.3.2 The Batch Adsorber Problem, 290 Problems, 297 References, 301 12 Approximate and Numerical Solution Methods for PDEs 303 12.1 Polynomial Approximation, 303 12.2 Singular Perturbation, 310 12.3 Finite Difference, 315 % CONTENTS 12.3.1 Notations, 316 12.3.2 Essence of the Method, 316 12.3.3 Tridiagonal Matrix and the Thomas Algorithm, 317 12.3.4 Linear Parabolic Partial Differential Equations, 318 12.3.5 Nonlinear Parabolic Partial Differential Equations, 321 12.3.6 Elliptic Equations, 322 12.4 Orthogonal Collocation for Solving PDEs, 324 12.4.1 Elliptic PDE, 324 12.4.2 Parabolic PDE: Example 1, 327 12.4.3 Coupled Parabolic PDE: Example 2, 328 12.5 Orthogonal Collocation on Finite Elements, 330 Problems, 335 References, 342 Appendix A: Review of Methods for Nonlinear Algebraic Equations 343 A.I The Bisection Algorithm, 343 A. 2 The Successive Substitution Method, 344 A.3 The Newton-Raphson Method, 346 A.4 Rate of Convergence, 348 A.5 Multiplicity, 349 A. 6 Accelerating Convergence, 349 References, 350 Appendix B: Derivation of the Fourier-Mellin Inversion Theorem 351 Appendix С : Table of Laplace Transforms 357 Appendix D: Numerical Integration 363 D.I Basic Idea of Numerical Integration, 363 D.2 Newton Forward Difference Polynomial, 364 D.3 Basic Integration Procedure, 364 D.3.1 Trapezoid Rule, 364 D.3. 2 Simpson s Rule, 365 D.4 Error Control and Extrapolation, 366 D.5 Gaussian Quadrature, 367 D.6 Radau Quadrature, 369 D.7 Lobatto Quadrature, 370 D.8 Concluding Remarks, 372 References, 372 Appendix E: Nomenclature 373 Postface 377 Index 379 Enables chemical engineers to use mathematics to solve common on-the-job problems With its clear explanations, examples, and problem sets, Applied Mathematics and Modeling for Chemical Engineers has enabled thousands of chemical engineers to apply mathematical principles to successfully solve practical problems. The book introduces traditional techniques to solve ordinary differential equations as well as analytical methods to deal with important classes of finite-difference equations. It then explores techniques for solving partial differential equations from classical methods to finite-transforms, culminating with numerical methods including orthogonal collocation. This Second Edition demonstrates how classical mathematics solves a broad range of new applications that have arisen since the publication of the acclaimed first edition. Readers will find new materials and problems dealing with such topics as: • Brain implant drug delivery • Carbon dioxide storage • Chemical reactions in nanotubes • Dissolution of pills and pharmaceutical capsules • Honeycomb reactors used in catalytic converters • New models of physical phenomena such as bubble coalescence Like the first edition, this Second Edition provides plenty of worked examples that explain each step on the way to finding a problem s solution. Homework problems at the end of each chapter are designed to encourage readers to more deeply examine the underlying logic of the mathematical techniques used to arrive at the answers. Readers can refer to the references, also at the end of each chapter, to explore individual topics in greater depth. Finally, the text s appendices provide additional information on numerical methods for solving algebraic equations as well as a detailed explanation of numerical integration algorithms. Applied Mathematics and Modeling for Chemical Ejigineers is recommended for all students in chemical engineering as well as professional chemical engineers who want to improve their ability to use mathematics to solve common on-the-job problems. RICHARD G. RICE, PhD, is Emeritus Professor at Louisiana State University and widely published in the areas <if chemical separations and two-phase flow. DUONG D. DO, PhD, is University Professor at the University of Queensland, Australia, and is well-known in the area of adsorption science. Cmer Illustration: Ruberia box Subscribe to our free Engineering eNewsletter at ISBN 17fl-l-llfl-DE47a-0 90000 I LEY 9 781118 02472
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id DE-604.BV040605939
illustrated Illustrated
indexdate 2024-12-24T02:54:50Z
institution BVB
isbn 9781118024720
language English
oai_aleph_id oai:aleph.bib-bvb.de:BVB01-025433606
oclc_num 819367815
open_access_boolean
owner DE-703
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physical XII, 383 S. graph. Darst.
publishDate 2012
publishDateSearch 2012
publishDateSort 2012
publisher Wiley
record_format marc
spellingShingle Rice, Richard G.
Do, Duong D.
Applied mathematics and modeling for chemical engineers
Mathematik (DE-588)4037944-9 gnd
Computerunterstütztes Verfahren (DE-588)4139030-1 gnd
Numerisches Verfahren (DE-588)4128130-5 gnd
Mathematisches Modell (DE-588)4114528-8 gnd
Angewandte Mathematik (DE-588)4142443-8 gnd
Simulation (DE-588)4055072-2 gnd
Chemische Verfahrenstechnik (DE-588)4069941-9 gnd
Technische Mathematik (DE-588)4827059-3 gnd
Differentialgleichung (DE-588)4012249-9 gnd
subject_GND (DE-588)4037944-9
(DE-588)4139030-1
(DE-588)4128130-5
(DE-588)4114528-8
(DE-588)4142443-8
(DE-588)4055072-2
(DE-588)4069941-9
(DE-588)4827059-3
(DE-588)4012249-9
title Applied mathematics and modeling for chemical engineers
title_auth Applied mathematics and modeling for chemical engineers
title_exact_search Applied mathematics and modeling for chemical engineers
title_full Applied mathematics and modeling for chemical engineers Richard G. Rice ; Duong D. Do
title_fullStr Applied mathematics and modeling for chemical engineers Richard G. Rice ; Duong D. Do
title_full_unstemmed Applied mathematics and modeling for chemical engineers Richard G. Rice ; Duong D. Do
title_short Applied mathematics and modeling for chemical engineers
title_sort applied mathematics and modeling for chemical engineers
topic Mathematik (DE-588)4037944-9 gnd
Computerunterstütztes Verfahren (DE-588)4139030-1 gnd
Numerisches Verfahren (DE-588)4128130-5 gnd
Mathematisches Modell (DE-588)4114528-8 gnd
Angewandte Mathematik (DE-588)4142443-8 gnd
Simulation (DE-588)4055072-2 gnd
Chemische Verfahrenstechnik (DE-588)4069941-9 gnd
Technische Mathematik (DE-588)4827059-3 gnd
Differentialgleichung (DE-588)4012249-9 gnd
topic_facet Mathematik
Computerunterstütztes Verfahren
Numerisches Verfahren
Mathematisches Modell
Angewandte Mathematik
Simulation
Chemische Verfahrenstechnik
Technische Mathematik
Differentialgleichung
url http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=025433606&sequence=000003&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA
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