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Applications of molecular simulation in the oil and gas industry / Philippe Ungerer

Public ISBD Titre : Applications of molecular simulation in the oil and gas industry : monte carlo methods Type de document : texte imprimé Auteurs : Philippe Ungerer, Auteur ; Bernard Tavitian (1960-....), Auteur ; Anne Boutin, Auteur Editeur : Paris : Technip Année de publication : 2005 Collection : IFP publications Importance : XII - 295 p. Format : 24 cm ISBN/ISSN/EAN : 978-2-7108-0858-9 Note générale : Bibliogr. p. [277]-290. Index Langues : Anglais (eng) Mots-clés : Pétrole  --  Industrie  et  commerce  --  Simulation,  Méthodes  de Gaz  --  Industrie  et  commerce  --  Simulation,  Méthodes  de Thermodynamique  statistique Monte-Carlo,  Méthode  de Pétrole,  Technique  du Index. décimale : 665.6 Technologie des huiles minérales. Technologie du pétrole et produits analogues Résumé : Molecular simulation is an emerging technology for determining the properties of many systems that are of interest to the oil and gas industry, and more generally to the chemical industry. Based on a universally accepted theoretical background, molecular simulation accounts for the precise structure of molecules in evaluating their interactions. Taking advantage of the availability of powerful computers at moderate cost, molecular simulation is now providing reliable predictions in many cases where classical methods (such as equations of state or group contribution methods) have limited prediction capabilities. This is particularly useful for designing processes involving toxic components, extreme pressure conditions, or adsorption selectivity in microporous adsorbents. Molecular simulation moreover provides a detailed understanding of system behaviour.As illustrated by their award from the American Institute of Chemical Engineers for the best overall performance at the Fluid Simulation Challenge 2004, the authors are recognized experts in Monte Carlo simulation techniques, which they use to address equilibrium properties.This book presents these techniques in suficient detail for readers to understand how simulation works, and describes many applications for industrially relevant problems. The book is primarily dedicated to chemical engineers who are not yet conversant with molecular simulation techniques. In addition, specialists in molecular simulation will be interested in the large scope of applications presented (including fluid properties, fluid phase equilibria, adsorption in zeolites, etc.). Note de contenu : Table des matières * Basics of molecular simulation. * Fluid phase equilibria and fluid properties Adsorption. Applications of molecular simulation in the oil and gas industry : monte carlo methods [texte imprimé] / Philippe Ungerer, Auteur ; Bernard Tavitian (1960-....), Auteur ; Anne Boutin, Auteur . - Technip, 2005 . - XII - 295 p. ; 24 cm. - (IFP publications) . ISBN : 978-2-7108-0858-9 Bibliogr. p. [277]-290. Index Langues : Anglais (eng) Mots-clés : Pétrole  --  Industrie  et  commerce  --  Simulation,  Méthodes  de Gaz  --  Industrie  et  commerce  --  Simulation,  Méthodes  de Thermodynamique  statistique Monte-Carlo,  Méthode  de Pétrole,  Technique  du Index. décimale : 665.6 Technologie des huiles minérales. Technologie du pétrole et produits analogues Résumé : Molecular simulation is an emerging technology for determining the properties of many systems that are of interest to the oil and gas industry, and more generally to the chemical industry. Based on a universally accepted theoretical background, molecular simulation accounts for the precise structure of molecules in evaluating their interactions. Taking advantage of the availability of powerful computers at moderate cost, molecular simulation is now providing reliable predictions in many cases where classical methods (such as equations of state or group contribution methods) have limited prediction capabilities. This is particularly useful for designing processes involving toxic components, extreme pressure conditions, or adsorption selectivity in microporous adsorbents. Molecular simulation moreover provides a detailed understanding of system behaviour.As illustrated by their award from the American Institute of Chemical Engineers for the best overall performance at the Fluid Simulation Challenge 2004, the authors are recognized experts in Monte Carlo simulation techniques, which they use to address equilibrium properties.This book presents these techniques in suficient detail for readers to understand how simulation works, and describes many applications for industrially relevant problems. The book is primarily dedicated to chemical engineers who are not yet conversant with molecular simulation techniques. In addition, specialists in molecular simulation will be interested in the large scope of applications presented (including fluid properties, fluid phase equilibria, adsorption in zeolites, etc.). Note de contenu : Table des matières * Basics of molecular simulation. * Fluid phase equilibria and fluid properties Adsorption.

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Code-barres	Cote	Support	Localisation	Section	Disponibilité	Etat_Exemplaire
049686	665.6 UNG	Papier	Bibliothèque Centrale	Génie Chimique	Disponible	En bon état