Modeling of Chemical Reactions Books

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Modeling of Chemical Reactions


Modeling of Chemical Reactions
  • Author : R.W. Carr
  • Publisher : Elsevier
  • Release : 2007-09-04
  • ISBN : 008054617X
  • Language : En, Es, Fr & De
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Modeling of Chemical Reactions covers detailed chemical kinetics models for chemical reactions. Including a comprehensive treatment of pressure dependent reactions, which are frequently not incorporated into detailed chemical kinetic models, and the use of modern computational quantum chemistry, which has recently become an extraordinarily useful component of the reaction kinetics toolkit. It is intended both for those who need to model complex chemical reaction processes but have little background in the area, and those who are already have experience and would benefit from having a wide range of useful material gathered in one volume. The range of subject matter is wider than that found in many previous treatments of this subject. The technical level of the material is also quite wide, so that non-experts can gain a grasp of fundamentals, and experts also can find the book useful. A solid introduction to kinetics Material on computational quantum chemistry, an important new area for kinetics Contains a chapter on construction of mechanisms, an approach only found in this book

Modelling of Chemical Reaction Systems


Modelling of Chemical Reaction Systems
  • Author : K.H. Ebert
  • Publisher : Springer
  • Release : 2011-12-10
  • ISBN : 3642682227
  • Language : En, Es, Fr & De
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For rather a long time numerical results in chemical kinetics could only be obtained for very simple chemical reactions, most of which were of minor practi ca 1 importance. The avail abil ity of fast computers has provi ded new opportunities for developments in chemical kinetics. Chemical systems of practical interest are usually very complicated. They consi st of a great number of different el ementary chemi cal reacti ons, mostly with rate constants differi ng by many orders of magni tude, frequently with surface reacti on steps and often wi th transport processes. The deri vati on of a 'true' chemical mechani sm can be extremely cumbersome. Mostly this work is done by setting up 'reaction models' which are im proved step by step in comparison with precise experimental data. At this early stage mathematics is involved, which may al ready be rather complicated. Mathematical methods such as pertubation theory, graph theory, sensitivity analysis or numerical integration are necessary for the derivation and application of optimal chemical reaction models. Most theoretical work aimed at improving the mathematical methods was done on chemical reactions which mostly were of little practical im portance. Chemi cal engi neers, who evi dently k now well how important the chemical model s and their dynamics are for reactor desi gn, have al so to be convinced not only on the theoretical work but also on its practical applic abil ity.

Mathematical Models of Chemical Reactions


Mathematical Models of Chemical Reactions
  • Author : Péter Érdi
  • Publisher : Manchester University Press
  • Release : 1989
  • ISBN : 0719022088
  • Language : En, Es, Fr & De
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Modeling of Chemical Kinetics and Reactor Design


Modeling of Chemical Kinetics and Reactor Design
  • Author : A. Kayode Coker
  • Publisher : Gulf Professional Publishing
  • Release : 2001
  • ISBN : 0884154815
  • Language : En, Es, Fr & De
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Selecting the best type of reactor for any particular chemical reaction, taking into consideration safety, hazard analysis, scale-up, and many other factors is essential to any industrial problem. An understanding of chemical reaction kinetics and the design of chemical reactors is key to the success of the of the chemist and the chemical engineer in such an endeavor. This valuable reference volume conveys a basic understanding of chemical reactor design methodologies, incorporating control, hazard analysis, and other topics not covered in similar texts. In addition to covering fluid mixing, the treatment of wastewater, and chemical reactor modeling, the author includes sections on safety in chemical reaction and scale-up, two topics that are often neglected or overlooked. As a real-world introduction to the modeling of chemical kinetics and reactor design, the author includes a case study on ammonia synthesis that is integrated throughout the text. The text also features an accompanying CD, which contains computer programs developed to solve modeling problems using numerical methods. Students, chemists, technologists, and chemical engineers will all benefit from this comprehensive volume. Shows readers how to select the best reactor design, hazard analysis, and safety in design methodology Features computer programs developed to solve modeling problems using numerical methods

Stochastic Modelling of Reaction Diffusion Processes


Stochastic Modelling of Reaction Diffusion Processes
  • Author : Radek Erban
  • Publisher : Cambridge University Press
  • Release : 2019-12-31
  • ISBN : 9781108498128
  • Language : En, Es, Fr & De
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Practical introduction for advanced undergraduate or beginning graduate students of applied mathematics, developed at the University of Oxford.