Chemical Hardness
Springer (Publisher)
Published on 3. October 2013
Book
Paperback/Softback
VII, 268 pages
978-3-662-14961-4 (ISBN)
Description
1. R.G. Pearson Chemical Hardness - An Historical Introduction 2. P.K. Chattaraj Density Functional Theory of Chemical Hardness 3. J.L. Gazqu z Hardness and Softness in Density Functional Theory 4. L. Komorowski Hardness Indices for Free and Bonded Atoms 5. N.H. March The Ground-State Energy of Atomic and Molecular Ions and Its Variation with the Number of Elections 6. K. Sen Isoelectronic Changes in energy, Electronegativity, and Hardness in Atoms via the Calculations of 7. P. Politzer, J.S. Murray, M.E. Grice Charge Capacities and Shell Structures of Atoms 8. R. F. Nalewajski The Hardness Based Molecular Charge Sensitivities and Their Use in the Theory of Chemical Reactivity 9. B.G. Baekelandt, R. A. Schoonheydt, W.J. Mortier The EEM Approach to Chemical Hardness in Molecules and Solids: Fundamentals and Applications 10. J.A. Alonso, L. C. Balbas Hardness of Metallic Clusters
More details
Series
Edition
Softcover reprint of the original 1st ed. 1993
Language
English
Place of publication
Berlin
Germany
Publishing group
Springer Berlin
Target group
Professional and scholarly
Research
Illustrations
VII, 268 p.
Dimensions
Height: 235 mm
Width: 155 mm
Thickness: 16 mm
Weight
429 gr
ISBN-13
978-3-662-14961-4 (9783662149614)
DOI
10.1007/BFb0036795
Schweitzer Classification
Other editions
Additional editions
Persons
Content
Chemical hardness - A historical introduction.- Density functional theory of chemical hardness.- Hardness and softness in density functional theory.- Hardness indices for free and bonded atoms.- The ground-state energy of atomic and molecular ions and its variation with the number of electrons.- Isoelectronic changes in energy, electronegativity, and hardness in atoms via the calculations of TANO.- Charge capacities and shell structures of atoms.- The hardness based molecular charge sensitivities and their use in the theory of chemical reactivity.- The EEM approach to chemical hardness in molecules and solids: Fundamentals and applications.- Hardness of metallic clusters.