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Applications of Density Functional Theory to Chemical Reactivity

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  • ISBN: 9783642327537
  • Physical Description: electronic
    electronic resource
    access
    remote
    IX, 189 p. 55 illus., 18 illus. in color. online resource.
  • Publisher: Berlin, Heidelberg : Springer Berlin Heidelberg : 2012.
Subject: Chemistry
Chemistry, inorganic
Chemistry
Inorganic Chemistry

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.
Search Results Showing Item 31 of 2681

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