Modern Charge-Density Analysis
(Sprache: Englisch)
Focusing on developments from the past 10-15 years, this volume presents an objective overview of the research in charge density analysis. The most promising methodologies are included, in addition to powerful interpretative tools and a survey of important areas of research.
Leider schon ausverkauft
versandkostenfrei
Buch (Gebunden)
Fr. 401.90
inkl. MwSt.
- Kreditkarte, Paypal, Rechnungskauf
- 30 Tage Widerrufsrecht
Produktdetails
Produktinformationen zu „Modern Charge-Density Analysis “
Focusing on developments from the past 10-15 years, this volume presents an objective overview of the research in charge density analysis. The most promising methodologies are included, in addition to powerful interpretative tools and a survey of important areas of research.
Klappentext zu „Modern Charge-Density Analysis “
Modern Charge-Density Analysis focuses on state-of-the-art methods and applications of electron-density analysis. It is a field traditionally associated with understanding chemical bonding and the electrostatic properties of matter. Recently, it has also been related to predictions of properties and responses of materials (having an organic, inorganic or hybrid nature as in modern materials and bio-science, and used for functional devices or biomaterials).
Modern Charge-Density Analysis is inherently multidisciplinary and written for chemists, physicists, crystallographers, material scientists, and biochemists alike. It serves as a useful tool for scientists already working in the field by providing them with a unified view of the multifaceted charge-density world. Additionally, this volume facilitates the understanding of scientists and PhD students planning to enter the field by acquainting them with the most significant and promising developments in this arena.
Modern Charge-Density Analysis is intended to provide a wide and objective overview of the research in the field of charge density analysis, especially focusing on the developments in the past 10-15 years (since the latest most comprehensive book on the subject was published) and on the major progress that has occurred.
This aim is pursued by combining an overview of the present status of the field, an updated description of the most promising methodologies, a presentation of the most successful and powerful interpretative tools and a survey of the potential insight in many important areas of research.
These requests are mirrored in the five sections that compose the book.
The editors have selected a range of authors who mainly 1) contributed during the last decade to the development of charge density methodologies 2)contributed the new tools which facilitated a greater chemical understanding and 3) successfully demonstrated the usefulness of the charge density analysis in different fields of science, including dynamic phenomena.
For most of the topics the editors will combine the expertise of authors who have worked independently with different perspectives and approaches. This provides a balanced and more exhaustive presentation of the selected subjects.
This aim is pursued by combining an overview of the present status of the field, an updated description of the most promising methodologies, a presentation of the most successful and powerful interpretative tools and a survey of the potential insight in many important areas of research.
These requests are mirrored in the five sections that compose the book.
The editors have selected a range of authors who mainly 1) contributed during the last decade to the development of charge density methodologies 2)contributed the new tools which facilitated a greater chemical understanding and 3) successfully demonstrated the usefulness of the charge density analysis in different fields of science, including dynamic phenomena.
For most of the topics the editors will combine the expertise of authors who have worked independently with different perspectives and approaches. This provides a balanced and more exhaustive presentation of the selected subjects.
Inhaltsverzeichnis zu „Modern Charge-Density Analysis “
A guided tour through modern charge density analysis.- Electron densities and related properties from the ab-initio simulation of crystalline solids.- Modeling and analysing thermal motion in experimental charge density studies.- Spin and the Complementary Worlds of Electron Position and Momentum Densities.- Past, present and future of charge density and density matrix refinements.- Using wavefunctions to get more information out of diffraction experiments.- Local Models for Joint Position and Momentum Density Studies.- Magnetization densities in material science.- Beyond Standard Charge Density Topological Analyses.- On the Interplay Between Real and Reciprocal Space Properties.- Intermolecular interaction energies from experimental charge density studies.- Chemical Information from Charge Density Studies.- Charge density in materials and energy science.- A generic force field based on Quantum Chemical Topology.- Frontier Applications of Experimental Charge Density and Electrostatics to Bio-Macromolecules.- Charge densities and crystal engineering.- Electron Density Topology of Crystalline Solids at High Pressure.- Bonding changes along solid-solid phase transitions using the Electron Localization Function approach.- Multi-temperature electron density studies.- Transient Charge Density Maps from Femtosecond X-Ray Diffraction.- Charge density and chemical reactions: a unified view from Conceptual DFT.
ostatics to Bio-Macromolecules.- Charge densities and crystal engineering.- Electron Density Topology of Crystalline Solids at High Pressure.- Bonding changes along solid-solid phase transitions using the Electron Localization Function approach.- Multi-temperature electron density studies.- Transient Charge Density Maps from Femtosecond X-Ray Diffraction.- Charge density and chemical reactions: a unified view from Conceptual DFT.
Autoren-Porträt
Carlo Gatti: Senior Research Scientist of CNR (Consiglio Nazionale delle Ricerche) at CNR-ISTM (Istituto di Scienze e Tecnologie Molecolari del CNR), via Golgi 19, 20133 Milano, Italy Piero Macchi: Researcher at the department of Structural Chemistry and Inorganic Stereochemistry, University of Milan. Since January 2009, he will be dozent and group leader of chemical crystallography at the department of Chemistry and biochemistry of the University of Bern (Switzerland)
Bibliographische Angaben
- 2012, 2012., 783 Seiten, Masse: 16 x 24,1 cm, Gebunden, Englisch
- Herausgegeben:Gatti, Carlo; Macchi, Piero
- Herausgegeben: Piero Macchi, Carlo Gatti
- Verlag: Springer Netherlands
- ISBN-10: 9048138353
- ISBN-13: 9789048138357
- Erscheinungsdatum: 19.01.2012
Sprache:
Englisch
Kommentar zu "Modern Charge-Density Analysis"
0 Gebrauchte Artikel zu „Modern Charge-Density Analysis“
| Zustand | Preis | Porto | Zahlung | Verkäufer | Rating |
|---|
Schreiben Sie einen Kommentar zu "Modern Charge-Density Analysis".
Kommentar verfassen