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Molecular Simulation Studies on Thermophysical Properties: With Application to Working Fluids (Molecular Modeling and Simulation) - Hardcover
Book 2 of 3: Molecular Modeling and Simulation
Synopsis
This book discusses the fundamentals of molecular simulation, starting with the basics of statistical mechanics and providing introductions to Monte Carlo and molecular dynamics simulation techniques. It also offers an overview of force-field models for molecular simulations and their parameterization, with a discussion of specific aspects. The book then summarizes the available know-how for analyzing molecular simulation outputs to derive information on thermophysical and structural properties. Both the force-field modeling and the analysis of simulation outputs are illustrated by various examples. Simulation studies on recently introduced HFO compounds as working fluids for different technical applications demonstrate the value of molecular simulations in providing predictions for poorly understood compounds and gaining a molecular-level understanding of their properties. This book will prove a valuable resource to researchers and students alike.
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About the Author
Dr. Gabriele Raabe graduated in Mechanical Engineering. She received her Ph.D. in experimental studies on vapor–liquid phase equilibria at low temperatures and their modeling by equations of state. She continued to work as thermodynamicist and senior scientist at the Institute for Thermodynamics, TU Braunschweig, and her research activities involve the modeling and prediction of thermophysical properties, focusing on force-field modeling and molecular simulation studies with a wide range of applications that cover, for instance, predicting the thermophysical properties of working fluids and refrigerants, studies on ionic liquids and simulations of drug solubilities. She also has many years of experience in teaching master’s courses on molecular simulations and thermodynamics of mixtures.
From the Back Cover
This book discusses the fundamentals of molecular simulation, starting with the basics of statistical mechanics and providing introductions to Monte Carlo and molecular dynamics simulation techniques. It also offers an overview of force-field models for molecular simulations and their parameterization, with a discussion of specific aspects. The book then summarizes the available know-how for analyzing molecular simulation outputs to derive information on thermophysical and structural properties. Both the force-field modeling and the analysis of simulation outputs are illustrated by various examples. Simulation studies on recently introduced HFO compounds as working fluids for different technical applications demonstrate the value of molecular simulations in providing predictions for poorly understood compounds and gaining a molecular-level understanding of their properties. This book will prove a valuable resource to researchers and students alike.
"About this title" may belong to another edition of this title.
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MOLECULAR SIMULATION STUDIES O
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Buch. Condition: Neu. This item is printed on demand - it takes 3-4 days longer - Neuware -This book discusses the fundamentals of molecular simulation, starting with the basics of statistical mechanics and providing introductions to Monte Carlo and molecular dynamics simulation techniques. It also offers an overview of force-field models for molecular simulations and theirparameterization, with a discussion of specific aspects. The book then summarizes the available know-how for analyzing molecular simulation outputs to derive information on thermophysical and structural properties. Both the force-field modeling and the analysis of simulation outputs are illustrated by various examples. Simulation studies on recently introduced HFO compounds as working fluids for different technical applications demonstrate the value of molecular simulations in providing predictions for poorly understood compounds and gaining a molecular-level understanding of their properties. This book will prove a valuable resource to researchers and students alike. 306 pp. Englisch. Seller Inventory # 9789811035449
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Molecular Simulation Studies on Thermophysical Properties
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Condition: New. Dieser Artikel ist ein Print on Demand Artikel und wird nach Ihrer Bestellung fuer Sie gedruckt. Provides a comprehensive, up-to-date summary of molecular modeling and simulation techniques Presents an introduction to the theoretical framework of statistical thermodynamics Offers an entire chapter devoted to force-field models f. Seller Inventory # 134145200
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Molecular Simulation Studies on Thermophysical Properties : With Application to Working Fluids
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Buch. Condition: Neu. Druck auf Anfrage Neuware - Printed after ordering - This book discusses the fundamentals of molecular simulation, starting with the basics of statistical mechanics and providing introductions to Monte Carlo and molecular dynamics simulation techniques. It also offers an overview of force-field models for molecular simulations and theirparameterization, with a discussion of specific aspects. The book then summarizes the available know-how for analyzing molecular simulation outputs to derive information on thermophysical and structural properties. Both the force-field modeling and the analysis of simulation outputs are illustrated by various examples. Simulation studies on recently introduced HFO compounds as working fluids for different technical applications demonstrate the value of molecular simulations in providing predictions for poorly understood compounds and gaining a molecular-level understanding of their properties. This book will prove a valuable resource to researchers and students alike. Seller Inventory # 9789811035449
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Molecular Simulation Studies on Thermophysical Properties
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ISBN 10: 981103544X
ISBN 13: 9789811035449
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Buch. Condition: Neu. This item is printed on demand - Print on Demand Titel. Neuware -This book discusses the fundamentals of molecular simulation, starting with the basics of statistical mechanics and providing introductions to Monte Carlo and molecular dynamics simulation techniques. It also offers an overview of force-field models for molecular simulations and their parameterization, with a discussion of specific aspects. The book then summarizes the available know-how for analyzing molecular simulation outputs to derive information on thermophysical and structural properties. Both the force-field modeling and the analysis of simulation outputs are illustrated by various examples. Simulation studies on recently introduced HFO compounds as working fluids for different technical applications demonstrate the value of molecular simulations in providing predictions for poorly understood compounds and gaining a molecular-level understanding of their properties. This book will prove a valuable resource to researchers and students alike.Springer-Verlag KG, Sachsenplatz 4-6, 1201 Wien 332 pp. Englisch. Seller Inventory # 9789811035449
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Molecular Simulation Studies on Thermophysical Properties: With Application to Working Fluids (Molecular Modeling and Simulation)
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Molecular Simulation Studies on Thermophysical Properties: With Application to Working Fluids (Molecular Modeling and Simulation)
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MOLECULAR SIMULATION STUDIES ON THERMOPHYSICAL PROPERTIES WITH APPLICATIONS TO WORKING FLUIDS (HB 2017)
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Condition: New. Brand New! Fast Delivery This is an International Edition and ship within 24-48 hours. Deliver by FedEx and Dhl, & Aramex, UPS, & USPS and we do accept APO and PO BOX Addresses. Order can be delivered worldwide within 6-10 days and we do have flat rate for up to 2LB. Extra shipping charges will be requested if the Book weight is more than 5 LB. This Item May be shipped from India, United states & United Kingdom. Depending on your location and availability. Seller Inventory # CBS 9789811035449
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Molecular Simulation Studies on Thermophysical Properties: With Application to Working Fluids (Molecular Modeling and Simulation)
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Molecular Simulation Studies on Thermophysical Properties: With Application to Working Fluids (Molecular Modeling and Simulation)
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