skip to content
Applications of density functional theory to chemical reactivity Preview this item
ClosePreview this item
Checking...

Applications of density functional theory to chemical reactivity

Author: Mihai V Putz; D M P Mingos; A Chatterjee; et al
Publisher: Berlin ; New York : Springer, ©2012.
Series: Structure and bonding, 149.
Edition/Format:   eBook : Document : EnglishView all editions and formats
Database:WorldCat
Summary:
Mihai V. Putz Density Functional Theory of Bose-Einstein Condensation: Road to Chemical Bonding Quantum CondensateRoman F. Nalewajski Information Theory Insights into Molecular Electronic Structure and ReactivityGeorge Maroulis Applying Conventional Ab Initio and Density Functional Theory Approaches to Electric Property Calculations. Quantitative Aspects and Perspectives.Sourav Pal Descriptors as Probes  Read more...
Rating:

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

Subjects
More like this

 

Find a copy online

Links to this item

Find a copy in the library

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

Details

Genre/Form: Electronic books
Additional Physical Format: Printed edition:
Material Type: Document, Internet resource
Document Type: Internet Resource, Computer File
All Authors / Contributors: Mihai V Putz; D M P Mingos; A Chatterjee; et al
ISBN: 9783642327537 3642327532 3642327524 9783642327520
OCLC Number: 826630696
Notes: Includes index.
Description: 1 online resource.
Contents: Density Functional Theory of Bose-Einstein Condensation: Road to Chemical Bonding Quantum Condensate / Mihai V. Putz --
Information Theory Insights into Molecular Electronic Structure and Reactivity / Roman F. Nalewajski --
Applying Conventional Ab Initio and Density Functional Theory Approaches to Electric Property Calculations. Quantitative Aspects and Perspectives / George Maroulis --
Descriptors as Probes for Inter-Molecular Interactions and External Perturbation / Sourav Pal --
Application of Reactivity Indices Within Density Functional Theory to Rationale Chemical Interactions / Abhijit Chatterjee.
Series Title: Structure and bonding, 149.
Responsibility: Mihai V. Putz, D. Michael P. Mingos, editors ; with contributions by A. Chatterjee...[et al.].

Abstract:

Mihai V. Putz Density Functional Theory of Bose-Einstein Condensation: Road to Chemical Bonding Quantum CondensateRoman F. Nalewajski Information Theory Insights into Molecular Electronic Structure and ReactivityGeorge Maroulis Applying Conventional Ab Initio and Density Functional Theory Approaches to Electric Property Calculations. Quantitative Aspects and Perspectives.Sourav Pal Descriptors as Probes for Inter-Molecular Interactions and External PerturbationAbhijit Chatterjee Application of Reactivity Indices within Density Functional Theory to Rationale Chemical Interactions

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/826630696> # Applications of density functional theory to chemical reactivity
    a schema:MediaObject, schema:Book, schema:CreativeWork ;
    library:oclcnum "826630696" ;
    library:placeOfPublication <http://experiment.worldcat.org/entity/work/data/1207223200#Place/berlin> ; # Berlin
    library:placeOfPublication <http://dbpedia.org/resource/New_York_City> ; # New York
    library:placeOfPublication <http://id.loc.gov/vocabulary/countries/gw> ;
    schema:about <http://experiment.worldcat.org/entity/work/data/1207223200#Topic/science_des_materiaux> ; # Science des matériaux
    schema:about <http://experiment.worldcat.org/entity/work/data/1207223200#Topic/chimie> ; # Chimie
    schema:about <http://experiment.worldcat.org/entity/work/data/1207223200#Thing/chemistry> ; # Chemistry.
    schema:about <http://dewey.info/class/541.28/e23/> ;
    schema:about <http://experiment.worldcat.org/entity/work/data/1207223200#Thing/inorganic_chemistry> ; # Inorganic Chemistry.
    schema:about <http://id.worldcat.org/fast/890362> ; # Density functionals
    schema:about <http://id.worldcat.org/fast/1090522> ; # Reactivity (Chemistry)
    schema:bookFormat schema:EBook ;
    schema:contributor <http://viaf.org/viaf/109120180> ; # D. M. P. Mingos
    schema:contributor <http://viaf.org/viaf/65943564> ; # Mihai V. Putz
    schema:contributor <http://viaf.org/viaf/164349884> ; # A. Chatterjee
    schema:copyrightYear "2012" ;
    schema:datePublished "2012" ;
    schema:description "Mihai V. Putz Density Functional Theory of Bose-Einstein Condensation: Road to Chemical Bonding Quantum CondensateRoman F. Nalewajski Information Theory Insights into Molecular Electronic Structure and ReactivityGeorge Maroulis Applying Conventional Ab Initio and Density Functional Theory Approaches to Electric Property Calculations. Quantitative Aspects and Perspectives.Sourav Pal Descriptors as Probes for Inter-Molecular Interactions and External PerturbationAbhijit Chatterjee Application of Reactivity Indices within Density Functional Theory to Rationale Chemical Interactions" ;
    schema:exampleOfWork <http://worldcat.org/entity/work/id/1207223200> ;
    schema:genre "Electronic books" ;
    schema:inLanguage "en" ;
    schema:isPartOf <http://worldcat.org/issn/0081-5993> ; # Structure and bonding,
    schema:isPartOf <http://experiment.worldcat.org/entity/work/data/1207223200#Series/structure_and_bonding> ; # Structure and bonding ;
    schema:isSimilarTo <http://worldcat.org/entity/work/data/1207223200#CreativeWork/> ;
    schema:name "Applications of density functional theory to chemical reactivity" ;
    schema:productID "826630696" ;
    schema:publication <http://www.worldcat.org/title/-/oclc/826630696#PublicationEvent/berlin_new_york_springer_c2012> ;
    schema:publisher <http://experiment.worldcat.org/entity/work/data/1207223200#Agent/springer> ; # Springer
    schema:url <http://dx.doi.org/10.1007/978-3-642-32753-7> ;
    schema:workExample <http://worldcat.org/isbn/9783642327520> ;
    schema:workExample <http://dx.doi.org/10.1007/978-3-642-32753-7> ;
    schema:workExample <http://worldcat.org/isbn/9783642327537> ;
    wdrs:describedby <http://www.worldcat.org/title/-/oclc/826630696> ;
    .


Related Entities

<http://dbpedia.org/resource/New_York_City> # New York
    a schema:Place ;
    schema:name "New York" ;
    .

<http://experiment.worldcat.org/entity/work/data/1207223200#Series/structure_and_bonding> # Structure and bonding ;
    a bgn:PublicationSeries ;
    schema:hasPart <http://www.worldcat.org/oclc/826630696> ; # Applications of density functional theory to chemical reactivity
    schema:name "Structure and bonding ;" ;
    .

<http://experiment.worldcat.org/entity/work/data/1207223200#Thing/inorganic_chemistry> # Inorganic Chemistry.
    a schema:Thing ;
    schema:name "Inorganic Chemistry." ;
    .

<http://experiment.worldcat.org/entity/work/data/1207223200#Topic/science_des_materiaux> # Science des matériaux
    a schema:Intangible ;
    schema:name "Science des matériaux" ;
    .

<http://id.worldcat.org/fast/1090522> # Reactivity (Chemistry)
    a schema:Intangible ;
    schema:name "Reactivity (Chemistry)" ;
    .

<http://id.worldcat.org/fast/890362> # Density functionals
    a schema:Intangible ;
    schema:name "Density functionals" ;
    .

<http://viaf.org/viaf/109120180> # D. M. P. Mingos
    a schema:Person ;
    schema:birthDate "1944" ;
    schema:familyName "Mingos" ;
    schema:givenName "D. M. P." ;
    schema:name "D. M. P. Mingos" ;
    .

<http://viaf.org/viaf/164349884> # A. Chatterjee
    a schema:Person ;
    schema:familyName "Chatterjee" ;
    schema:givenName "A." ;
    schema:name "A. Chatterjee" ;
    .

<http://viaf.org/viaf/65943564> # Mihai V. Putz
    a schema:Person ;
    schema:familyName "Putz" ;
    schema:givenName "Mihai V." ;
    schema:name "Mihai V. Putz" ;
    .

<http://worldcat.org/entity/work/data/1207223200#CreativeWork/>
    a schema:CreativeWork ;
    schema:description "Printed edition:" ;
    schema:isSimilarTo <http://www.worldcat.org/oclc/826630696> ; # Applications of density functional theory to chemical reactivity
    .

<http://worldcat.org/isbn/9783642327520>
    a schema:ProductModel ;
    schema:description "print" ;
    schema:isbn "3642327524" ;
    schema:isbn "9783642327520" ;
    .

<http://worldcat.org/isbn/9783642327537>
    a schema:ProductModel ;
    schema:description "electronic bk." ;
    schema:isbn "3642327532" ;
    schema:isbn "9783642327537" ;
    .

<http://worldcat.org/issn/0081-5993> # Structure and bonding,
    a bgn:PublicationSeries ;
    schema:hasPart <http://www.worldcat.org/oclc/826630696> ; # Applications of density functional theory to chemical reactivity
    schema:issn "0081-5993" ;
    schema:name "Structure and bonding," ;
    .


Content-negotiable representations

Close Window

Please sign in to WorldCat 

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