libri scuola books Fumetti ebook dvd top ten sconti 0 Carrello


Torna Indietro

mcweeny r. (curatore); maruani jean (curatore); smeyers y.g. (curatore); wilson s. (curatore) - quantum systems in chemistry and physics. trends in methods and applications

Quantum Systems in Chemistry and Physics. Trends in Methods and Applications

; ; ;




Disponibilità: Normalmente disponibile in 15 giorni


PREZZO
162,98 €
NICEPRICE
154,83 €
SCONTO
5%



Questo prodotto usufruisce delle SPEDIZIONI GRATIS
selezionando l'opzione Corriere Veloce in fase di ordine.


Pagabile anche con Carta della cultura giovani e del merito, 18App Bonus Cultura e Carta del Docente


Facebook Twitter Aggiungi commento


Spese Gratis

Dettagli

Genere:Libro
Lingua: Inglese
Editore:

Springer

Pubblicazione: 10/2012
Edizione: 1997





Trama

Quantum Systems in Chemistry and Physics contains a refereed selection of the papers presented at the first European Workshop on this subject, held at San Miniato, near Pisa, Italy, in April 1996.
The Workshop brought together leading experts in theoretical chemistry and molecular physics with an interest in the quantum mechanical many-body problem. This volume provides an insight into the latest research in this increasingly important field. Throughout the Workshop, the emphasis was on innovative theory and conceptual developments rather than on computational implementation. The various contributions presented reflect this emphasis and embrace topics such as density matrices and density functional theory, relativistic formulations, electron correlation, valence theory, nuclear motion, response theory, condensed matter, and chemical reactions.
Audience: The volume will be of interest to those working in the molecular sciences and to theoretical chemists and molecular physicists in particular.




Sommario

*The European Workshop “Quantum Systems in Chemistry and Physics”.- *Separability in Quantum Mechanics.- *Optimized Effective Potential for Atoms and Molecules.- *The Relativistic Quantum Defect Orbital Method and Some of its Applications.- *A New Approach for Valence-bond Calculations: CASVB.- *Studies on Chemical Structure, Spectroscopy and Electron Scattering Using Generalized Multistructural Wavefunctions.- *The Characteristic (Crossover) Temperature in the Theory of Thermally Activated Tunneling Processes.- *An Improved method of Relaxation Rate Calculation in Double-well Potential Systems.- *Correlation Effects in the Double Proton Transfer of the Formic Acid Dimer.- *Effect of the Vibrational/Rotational Energy Partitioning on the Energy Transfer in Atom-triatomic Molecule Collisions.- *Fragmentation of Ar3+: the Role of Rotational and Vibrational Predissociation Dynamics.- *Sampling the Initial Conditions for Quasi-classical Trajectory Studies of Vibrational Predissociation Dynamics.- *Energy Estimates for Local Chemical Processes in Condensed Matter.- *Theoretical Study of the TiO2 and MgO Surface Acidity and the Adsorption of Acids and Bases.- *Optical Spectra of High-temperature Superconductors.- Multireference Brillouin—Wigner Coupled-Cluster Theory: Hilbert Space Approach.- Core-Valence Separation for an Open-shell Atom in the LST-DFT Scheme.- On the Accuracy of the Algebraic Approximation in Molecular Electronic Structure Studies: Matrix Valence-bond Calculations for the Hydrogen Molecule Ground State.- On the Evaluation of the Matrix Elements Between Non-Orthogonal Slater Determinants.- The Calculation of Some Processes Involving Transitions in the Continuum.- Revisiting the Off-center Impurity Problem: Reorientational Rates of Hindered Rotators.










Altre Informazioni

ISBN:

9789401060523

Condizione: Nuovo
Collana: Topics in Molecular Organization and Engineering
Dimensioni: 240 x 160 mm
Formato: Brossura
Illustration Notes:VIII, 399 p.
Pagine Arabe: 399
Pagine Romane: viii


Dicono di noi