Cantitate/Preț
Produs
Total produse
Vezi coșul
Quantum Systems in Chemistry and Physics, Part II de Per-Olov Lowdin

Quantum Systems in Chemistry and Physics, Part II: Advances in Quantum Chemistry, cartea 32

Per-Olov Lowdin Erkki J. Brändas, Michael C. Zerner, John R. Sabin Y. G. Smeyers, R. McWeeny, Julia Maruani, S. Wilson, Paul Grout MBE
en Limba Engleză Hardback – 4 noi 1998
The description of quantum systems is fundamental to an understanding of many problems in chemistry and physics. This volume records a representative slection of the papers delivered at the second European Workshop on Quantum Systems in Chemistry and Physics which was held at Jesus College, Oxford, April 6-9, 1997. The purpose of this international Workshop was to bring together chemists and physicists with a common interest--the quantum mechanical many-body problem--and to encourage collaboration and exchange of ideas on the fundamentals by promoting innovative theory and conceptual development rather than improvements in computatorial techniques and routine applications.

  • Covers the following topics:
    • Density matrices and density functional theory
    • Electron correlation
    • Relativistic effects
    • Valence theory
    • Nuclear motion
    • Response theory
    • Condensed matter
    • Chemical reactions
Citește tot Restrânge

Din seria Advances in Quantum Chemistry

Preț: 139757 lei

Preț vechi: 191449 lei
-27% Nou

Puncte Express: 2096
Preț estimativ în valută:
26749€ • 27804$ • 22158£

Carte tipărită la comandă

Livrare economică 05-19 februarie 25

 Adaugă în coș

Wish list
Gift list
Am citit!
Adaugă în listă
Preluare comenzi: 021 569.72.76

Specificații

ISBN-13: 9780120348336
ISBN-10: 0120348330
Pagini: 338
Dimensiuni: 152 x 229 x 22 mm
Greutate: 0.72 kg
Editura: ELSEVIER SCIENCE
Seria Advances in Quantum Chemistry

Public țintă

AUDIENCE: Researchers in quantum chemistry, mathematics, biology, and physics. Universities and industrial research and development groups working on biological molecules and new materials.

Cuprins

H.M. Quiney, H. Skaane, and I.P. Grant, Ab Initio Relativistic Quantum Chemistry: Four-Components Good, Two-Components Bad! D.L. Cooper, T. Thorsteinsson, and J. Gerratt, Modern VB Representations of CASSCF Wave Functions and the Fully-Variational Optimization of Modern VB Wave Functions Using the CASVB Strategy. A. Kalemos and A. Mavridis, On the Electronic Structure of ScB+: Ground and Low-Lying Excited States. A. Szarecka, G. Day, P.J. Grout, and S. Wilson, On the Effects of Basis Set Truncation and Electron Correlation in the Conformers of 2-Hydroxy-Acetamide. M. Hoffmann, A. Szarecka, and J. Rychlewski, Gas-Phase Conformational Analysis of (R,R)-Tartaric Acid, Its Diamide, N,N,N',N'-Tetramethyldiamide and Model. C. Petrongolo, Recent Theoretical Developments in Conical-Intersection Effects in Triatomic Spectra. Y.G. Smeyers, M.L. Senent, and M. Villa, Ab Initio Determination of Band Structures of Vibrational Spectra of Non-Rigid Molecules: Applications to Methylamine and Dimethylamine. R.G. Woolley, Gauge Invariance and Multipole Moments. I. Martin, C. Lavin, Y. Pérez-Delgado, J. Karwowski, and G.H.F. Diercksen, Vertical Electron Transitions in Rydberg Radicals. V. Véniard, R. Taïeb, and A. Maquet, Time-Dependent Quantum Treatment of Two-Colour Multiphoton Ionization Using a Strong Laser Pulse and High-Order Harmonic Radiation. M. Bylicki, Methods Involving Complex Coordinates Applied to Atoms. C. Amovilli, V. Barone, R. Cammi, E. Cancès, M. Cossi, B. Mennucci, C.S. Pomelli, and J. Tomasi, Recent Advances in the Description of Solvent Effects with the Polarization Continuum Model. M. Raimondi, A. Famulari, E. Gianinetti, M. Sorani, R. Specchio, and I. Vandoni, New Ab Initio VB Interaction Potential for Molecular Dynamics Simulation of Liquid Water. G.K.A. Keith, P.J. Grout, and S. Wilson, Systematic Sequences of Even-Tempered Gaussian Primatives for Diatomic Molecules in Solution: A Preliminary Study Using Continuum Solvation Models. J. Lingerberg, Beyond the Transition State Treatment. Subject Index.

Recenzii

Praise for the Series "Quantum chemistry has emerged as a subject in its own right. The appearance of a review publication which surveys recent achievements in the field is therefore very appropriate and, when it has the quality of this volume, is most welcome." --PROCEEDINGS OF THE PHYSICAL SOCIETY
"The juxtaposition of the oldest of quantum chemical studies, atomic structure, and one of the newest, quantum biology, highlights the importance of quantum theory in modern chemistry. Thus, having first opened the book in search of a particular article,the reader is stimulated to delve into fields of which he has but a superficial knowledge. In this way the book can be instrumental in broadening the interests and background of those who turn to it." --THE ROYAL INSTITUTE OF CHEMISTRY