Fundamental World of Quantum Chemistry - nieuw boek

EAN (ISBN-13): 9781402012860
ISBN (ISBN-10): 1402012861
Gebonden uitgave
Verschijningsjaar: 2003
Uitgever: Springer-Verlag New York Inc.

Boek bevindt zich in het datenbestand sinds 2008-03-04T20:05:17+01:00 (Amsterdam)
Detailpagina laatst gewijzigd op 2024-03-15T09:16:13+01:00 (Amsterdam)
ISBN/EAN: 9781402012860

ISBN - alternatieve schrijfwijzen:
1-4020-1286-1, 978-1-4020-1286-0
alternatieve schrijfwijzen en verwante zoekwoorden:
Auteur van het boek: erkki, oppenheimer, schrödinger
Titel van het boek: fundamental world quantum, quantum chemistry, the quantum world, the fundamentals volume

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Gegevens van de uitgever

Auteur: Erkki J. Brändas; Eugene S. Kryachko
Titel: Fundamental World of Quantum Chemistry - A Tribute to the Memory of Per-Olov Löwdin
Uitgeverij: Springer; Springer Netherland
1373 Bladzijden
Verschijningsjaar: 2003-07-31
Dordrecht; NL
Taal: Engels
181,89 € (DE)
186,99 € (AT)
201,00 CHF (CH)
Available
LXIII, 1373 p. In 2 volumes, not available separately.

SA; BB; Hardcover, Softcover / Chemie/Physikalische Chemie; Physikalische Chemie; Verstehen; Physical Chemistry; Quantum Physics; Biophysics; Quantenphysik (Quantenmechanik und Quantenfeldtheorie); Biophysik; BC

Per-Olov Löwdin, A Scientific and Personal Appreciation.- The Swedish Doorman, Poem.- The Kind and Personal Influence of Per-Olov Löwdin.- P.-O. Löwdin and The Quantum Mechanics of Molecules.- Symmetry Breaking in the Independent Particle Model.- The Hueckel-Hubbard Hamiltonian and Its Gel’fand Basis.- Different Orbitals for Different Spins, Löwdin’s Idea.- The Pauli Exclusive Principle, Spin-Statistics Connection, and Permutation Symmetry of Many-Particle Wave Functions.- The Length and Breadth of Löwdin-Orthogonalizations.- Correlation Between Position and Momentum. A Phase-Space View.- Harmonic Polynomials, Hyperspherical Harmonics, and Sturmians.- Sturmian Orbitals in Quantum Chemistry: An Introduction.- Molecular Orbital Calculations with Numerically Optimized Orbital Bases.- About Overlap and Chemical Reality.- Quantum Mechanics of Many-Electron Systems and the Theories of Chemical Bond.- Brillouin-Wigner Expansions In Quantum Chemistry A Robust Approach to the Quantum Many-Body Problem in Molecules.- Partitioning Techniques In Coupled-Cluster Theory.- Density Matrix Theory - A Retrospective.- Geometric Aspects of the Theory of Density Matrices and Densities.- Density Matrix Variational Theory: Strength of Weinhold-Wilson Inequalities.- Density Matrices for Electrons with Strong Interactions.- Analytical Hartree-Fock Wave Functions for Atoms and Ions.- The Origin of the Molecular Atomization Energy Explained with the HF and HF-CC Models.- Some Exact Energy Relationships.- Shell Effects in the Relaxation Energy of ls-Core Ionization of Atoms from He through Xe.- Second Order Properties in Tensor Product Space by CI Techniques: Computation of Dispersion Constants.- Non Hermitian Quantum Mechanics: Formalism and Applications.- On The Geometric Phase Effectin Jahn-Teller Systems.- Recent Developments and Applications of the State-Specific Approach to Excited States and Their Dynamics.- Accurate Determination of Partial Rates from Multichannel Wave Function.- Green Function for Elastic Scattering from Open-Shell Many-Body Targets.- Understanding the Rates of Chemical Reactions.- Multichannel Quantum-Classical Diffusion Equations.- Field Energy Density in Chemical Reaction Systems.- Quantum Chemical Methods Applied to Solids.- Superconducting and Spin Gaps in dX2-y2-Wave High Tc Cuprates.- Quantum Theory of Disordered Chains.- Molecular Orbital Theory of the Gaseous Bose-Einstein Condensate: Natural Orbital Analysis of Strongly Correlated Ground and Excited States of An Atomic Condensate in A Double Well.- Model Studies of the Electrophilic Substitution of Methane with Various Electrophiles E (E = NO2+, F+, Cl+, Cl3+, HBr2+, HCO+ OH+, H2O-OH+, and Li+).- Application of MRD-CI for Computing Excited States of Radical Reactions Important for Atmospheric Chemistry: The Electronic Spectrum of Bromine Nitrate BrONO2 in Comparison to Isovalent ClONO2 and Photodissociation of BrONO2 along O-N and Br-O Cleavage.- Nitrous Oxide: Electron Attachment and Possible Scenario for Its Reaction with ns Metal Atoms.- Heavy Element Quantum Chemistry -The Multiconfigurational Approach.- Density Functional Theory Performance in Metal-Containing Systems.- Revival of Parametrized Theoretical Methods for Applied Science Studies: The Example of Transition-Metal Clusters.- Quantum Chemical Calculations of Molecular G-Tensors of Biological Radicals.- Electron Propagator Calculations on the Ionization Energies of Nucleic Acid Bases, Base-Water Complexes and Base Dimers.- Effects of Ionization and Cationization on Intermolecular Proton Transfer Reactions in DNA Base Pairs.- The Origin of Spontaneous Point Tautomeric Mutations in DNA: Löwdin’s Mechanism of Proton Tunneling in DNA Base Pairs.- Modern Quantum Look At The Periodic Table of Elements.- Löwdin’s Remarks on the Aufbau Principle and a Philosopher’s View of Ab Initio Quantum Chemistry.