Applications of Density Functional Theory to Chemical Reactivity

Mihai V. Putz  Density Functional Theory of Bose-Einstein Condensation: Road to Chemical Bonding Quantum Condensate Roman F. Nalewajski  Information Theory Insights into Molecular Electronic Structure and Reactivity George Maroulis         Applying Conventional Ab Initio and Density Functional Theor...

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Detalles Bibliográficos
Clasificación:Libro Electrónico
Autor Corporativo: SpringerLink (Online service)
Otros Autores: Putz, Mihai V. (Editor ), Mingos, D. Michael P. (Editor )
Formato: Electrónico eBook
Idioma:Inglés
Publicado: Berlin, Heidelberg : Springer Berlin Heidelberg : Imprint: Springer, 2012.
Edición:1st ed. 2012.
Colección:Structure and Bonding, 149
Temas:
Inorganic chemistry.
Inorganic Chemistry.
Acceso en línea:Texto Completo
Descripción
Sumario:Mihai V. Putz  Density Functional Theory of Bose-Einstein Condensation: Road to Chemical Bonding Quantum Condensate Roman F. Nalewajski  Information Theory Insights into Molecular Electronic Structure and Reactivity George 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 Perturbation Abhijit Chatterjee       Application of Reactivity Indices within Density Functional Theory to Rationale Chemical Interactions.
Descripción Física:IX, 189 p. online resource.
ISBN:9783642327537
ISSN:1616-8550 ;

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