skip to content
Molecular simulation studies on thermophysical properties : with application to working fluids Preview this item
ClosePreview this item
Checking...

Molecular simulation studies on thermophysical properties : with application to working fluids

Author: Gabriele Raabe
Publisher: Singapore : Springer, [2017] ©2017
Series: Molecular modeling and simulation.
Edition/Format:   eBook : Document : EnglishView all editions and formats
Summary:
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  Read more...
Rating:

(not yet rated) 0 with reviews - Be the first.

Subjects
More like this

Find a copy in the library

&AllPage.SpinnerRetrieving; Finding libraries that hold this item...

Details

Genre/Form: Electronic books
Electronic book
Additional Physical Format: Print version:
Raabe, Gabriele.
Molecular simulation studies on thermophysical properties.
Singapore : Springer, [2017]
(OCoLC)964645646
Material Type: Document, Internet resource
Document Type: Internet Resource, Computer File
All Authors / Contributors: Gabriele Raabe
ISBN: 9789811035456 9811035458
OCLC Number: 973325282
Description: 1 online resource.
Contents: Introduction --
Introduction to Statistical Mechanics --
Monte Carlo Simulations --
Molecular Dynamics Simulations --
Running Molecular Simulations --
Molecular Models (Force Fields) --
Thermophysical and Structural Properties from Molecular Simulation --
Applications of Molecular Simulations to Studies on Working Fluids --
Conclusion and Outlook --
A Force Field Parameters.
Series Title: Molecular modeling and simulation.
Responsibility: Gabriele Raabe.

Abstract:

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.

Reviews

User-contributed reviews
Retrieving GoodReads reviews...
Retrieving DOGObooks reviews...

Tags

Be the first.
Confirm this request

You may have already requested this item. Please select Ok if you would like to proceed with this request anyway.

Linked Data


Primary Entity

<http://www.worldcat.org/oclc/973325282> # Molecular simulation studies on thermophysical properties : with application to working fluids
    a schema:CreativeWork, schema:MediaObject, schema:Book ;
    library:oclcnum "973325282" ;
    library:placeOfPublication <http://id.loc.gov/vocabulary/countries/si> ;
    schema:about <http://experiment.worldcat.org/entity/work/data/4084160635#Topic/statistical_mechanics> ; # Statistical mechanics
    schema:about <http://experiment.worldcat.org/entity/work/data/4084160635#Topic/atomic_molecular_structure_and_spectra> ; # Atomic/Molecular Structure and Spectra
    schema:about <http://experiment.worldcat.org/entity/work/data/4084160635#Topic/engineering_fluid_dynamics> ; # Engineering Fluid Dynamics
    schema:about <http://experiment.worldcat.org/entity/work/data/4084160635#Topic/technology_&_engineering_reference> ; # TECHNOLOGY & ENGINEERING--Reference
    schema:about <http://experiment.worldcat.org/entity/work/data/4084160635#Topic/engineering> ; # Engineering
    schema:about <http://experiment.worldcat.org/entity/work/data/4084160635#Topic/materials_thermal_properties> ; # Materials--Thermal properties
    schema:about <http://experiment.worldcat.org/entity/work/data/4084160635#Topic/engineering_thermodynamics_heat_and_mass_transfer> ; # Engineering Thermodynamics, Heat and Mass Transfer
    schema:about <http://dewey.info/class/620.11296/e23/> ;
    schema:about <http://experiment.worldcat.org/entity/work/data/4084160635#Topic/technology_&_engineering_engineering_general> ; # TECHNOLOGY & ENGINEERING--Engineering (General)
    schema:author <http://experiment.worldcat.org/entity/work/data/4084160635#Person/raabe_gabriele> ; # Gabriele Raabe
    schema:bookFormat schema:EBook ;
    schema:copyrightYear "2017" ;
    schema:datePublished "2017" ;
    schema:description "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."@en ;
    schema:description "Introduction -- Introduction to Statistical Mechanics -- Monte Carlo Simulations -- Molecular Dynamics Simulations -- Running Molecular Simulations -- Molecular Models (Force Fields) -- Thermophysical and Structural Properties from Molecular Simulation -- Applications of Molecular Simulations to Studies on Working Fluids -- Conclusion and Outlook -- A Force Field Parameters."@en ;
    schema:exampleOfWork <http://worldcat.org/entity/work/id/4084160635> ;
    schema:genre "Electronic book"@en ;
    schema:genre "Electronic books"@en ;
    schema:inLanguage "en" ;
    schema:isPartOf <http://worldcat.org/issn/2364-5091> ; # Molecular modeling and simulation.
    schema:isSimilarTo <http://www.worldcat.org/oclc/964645646> ;
    schema:name "Molecular simulation studies on thermophysical properties : with application to working fluids"@en ;
    schema:productID "973325282" ;
    schema:url <http://rave.ohiolink.edu/ebooks/ebc/9789811035456> ;
    schema:url <https://link.springer.com/openurl?genre=book&isbn=978-981-10-3544-9> ;
    schema:url <http://link.springer.com/openurl?genre=book&isbn=978-981-10-3544-9> ;
    schema:url <http://public.eblib.com/choice/publicfullrecord.aspx?p=4810081> ;
    schema:url <https://link.springer.com/10.1007/978-981-10-3545-6> ;
    schema:url <http://search.ebscohost.com/login.aspx?direct=true&scope=site&db=nlebk&db=nlabk&AN=1470950> ;
    schema:url <http://VH7QX3XE2P.search.serialssolutions.com/?V=1.0&L=VH7QX3XE2P&S=JCs&C=TC0001775008&T=marc&tab=BOOKS> ;
    schema:url <http://www.myilibrary.com?id=994309> ;
    schema:url <https://0-link-springer-com.pugwash.lib.warwick.ac.uk/10.1007/978-981-10-3545-6> ;
    schema:url <http://sfx.carli.illinois.edu/sfxwhe/sfx_local?genre=book&sid=Voyager:WHE&sfx.ignore_date_threshold=1&svc.fulltext=yes&rft.isbn=978-981-10-3545-6> ;
    schema:url <http://libproxy.uwyo.edu/login/?url=http://dx.doi.org/10.1007/978-981-10-3545-6> ;
    schema:url <http://public.ebookcentral.proquest.com/choice/publicfullrecord.aspx?p=4810081> ;
    schema:url <http://link.springer.com/10.1007/978-981-10-3545-6> ;
    schema:url <http://dx.doi.org/10.1007/978-981-10-3545-6> ;
    schema:url <https://0-link-springer-com.pugwash.lib.warwick.ac.uk/book/10.1007/978-981-10-3545-6> ;
    schema:url <http://books.scholarsportal.info/viewdoc.html?id=/ebooks/ebooks3/springer/2017-08-17/11/9789811035456> ;
    schema:workExample <http://dx.doi.org/10.1007/978-981-10-3545-6> ;
    schema:workExample <http://worldcat.org/isbn/9789811035456> ;
    wdrs:describedby <http://www.worldcat.org/title/-/oclc/973325282> ;
    .


Related Entities

<http://experiment.worldcat.org/entity/work/data/4084160635#Person/raabe_gabriele> # Gabriele Raabe
    a schema:Person ;
    schema:familyName "Raabe" ;
    schema:givenName "Gabriele" ;
    schema:name "Gabriele Raabe" ;
    .

<http://experiment.worldcat.org/entity/work/data/4084160635#Topic/atomic_molecular_structure_and_spectra> # Atomic/Molecular Structure and Spectra
    a schema:Intangible ;
    schema:name "Atomic/Molecular Structure and Spectra"@en ;
    .

<http://experiment.worldcat.org/entity/work/data/4084160635#Topic/engineering_fluid_dynamics> # Engineering Fluid Dynamics
    a schema:Intangible ;
    schema:name "Engineering Fluid Dynamics"@en ;
    .

<http://experiment.worldcat.org/entity/work/data/4084160635#Topic/engineering_thermodynamics_heat_and_mass_transfer> # Engineering Thermodynamics, Heat and Mass Transfer
    a schema:Intangible ;
    schema:name "Engineering Thermodynamics, Heat and Mass Transfer"@en ;
    .

<http://experiment.worldcat.org/entity/work/data/4084160635#Topic/materials_thermal_properties> # Materials--Thermal properties
    a schema:Intangible ;
    schema:name "Materials--Thermal properties"@en ;
    .

<http://experiment.worldcat.org/entity/work/data/4084160635#Topic/statistical_mechanics> # Statistical mechanics
    a schema:Intangible ;
    schema:name "Statistical mechanics"@en ;
    .

<http://experiment.worldcat.org/entity/work/data/4084160635#Topic/technology_&_engineering_engineering_general> # TECHNOLOGY & ENGINEERING--Engineering (General)
    a schema:Intangible ;
    schema:name "TECHNOLOGY & ENGINEERING--Engineering (General)"@en ;
    .

<http://experiment.worldcat.org/entity/work/data/4084160635#Topic/technology_&_engineering_reference> # TECHNOLOGY & ENGINEERING--Reference
    a schema:Intangible ;
    schema:name "TECHNOLOGY & ENGINEERING--Reference"@en ;
    .

<http://worldcat.org/isbn/9789811035456>
    a schema:ProductModel ;
    schema:isbn "9811035458" ;
    schema:isbn "9789811035456" ;
    .

<http://worldcat.org/issn/2364-5091> # Molecular modeling and simulation.
    a bgn:PublicationSeries ;
    schema:hasPart <http://www.worldcat.org/oclc/973325282> ; # Molecular simulation studies on thermophysical properties : with application to working fluids
    schema:issn "2364-5091" ;
    schema:name "Molecular modeling and simulation." ;
    schema:name "Molecular modeling and simulation," ;
    .

<http://www.worldcat.org/oclc/964645646>
    a schema:CreativeWork ;
    rdfs:label "Molecular simulation studies on thermophysical properties." ;
    schema:description "Print version:" ;
    schema:isSimilarTo <http://www.worldcat.org/oclc/973325282> ; # Molecular simulation studies on thermophysical properties : with application to working fluids
    .

<http://www.worldcat.org/title/-/oclc/973325282>
    a genont:InformationResource, genont:ContentTypeGenericResource ;
    schema:about <http://www.worldcat.org/oclc/973325282> ; # Molecular simulation studies on thermophysical properties : with application to working fluids
    schema:dateModified "2018-11-23" ;
    void:inDataset <http://purl.oclc.org/dataset/WorldCat> ;
    .


Content-negotiable representations

Close Window

Please sign in to WorldCat 

Don't have an account? You can easily create a free account.