Описание: Advances in Quantum Methods and Applications in Chemistry, Physics, and Biology includes peer-reviewed contributions based on carefully selected presentations given at the 17th International Workshop on Quantum Systems in Chemistry, Physics, and Biology.
Автор: Alfonso Hern?ndez-Laguna; J. Maruani; R. McWeeny; Название: Quantum Systems in Chemistry and Physics ISBN: 0792359690 ISBN-13(EAN): 9780792359692 Издательство: Springer Рейтинг: Цена: 26122.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: Contains forty papers from the third European Quantum Systems in Chemistry and Physics Workshop held in Granada, Spain (1997). These books cover a spectrum of scientific research work from quantum-mechanical many-body methods to applications and computational developments, and from atoms and molecules to condensed matter.
Автор: Alfonso Hern?ndez-Laguna; J. Maruani; R. McWeeny; Название: Quantum Systems in Chemistry and Physics ISBN: 0792359704 ISBN-13(EAN): 9780792359708 Издательство: Springer Рейтинг: Цена: 30606.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: Contains forty papers from the third European Quantum Systems in Chemistry and Physics Workshop held in Granada, Spain (1997). These books cover a spectrum of scientific research work from quantum-mechanical many-body methods to applications and computational developments, and from atoms and molecules to condensed matter.
Автор: J. Maruani; Christian Minot; R. McWeeny; Y.G. Smey Название: New Trends in Quantum Systems in Chemistry and Physics ISBN: 079236709X ISBN-13(EAN): 9780792367093 Издательство: Springer Рейтинг: Цена: 22359.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: Contains the contributions to the fourth European Quantum Systems in Chemistry and Physics workshop held in Marly, France, in 1999. This title covers topics that include response theory, reactive collisions and chemical reactions and condensed matter.
Автор: Otero de la Roza, Alberto Название: Non-covalent Interactions in Quantum Chemistry and Physics ISBN: 012809835X ISBN-13(EAN): 9780128098356 Издательство: Elsevier Science Рейтинг: Цена: 33013.00 р. Наличие на складе: Поставка под заказ.
Описание:
Non-covalent Interactions in Quantum Chemistry and Physics: Theory and Applications provides an entry point for newcomers and a standard reference for researchers publishing in the area of non-covalent interactions. Written by the leading experts in this field, the book enables experienced researchers to keep up with the most recent developments, emerging methods, and relevant applications.
The book gives a comprehensive, in-depth overview of the available quantum-chemistry methods for intermolecular interactions and details the most relevant fields of application for those techniques. Theory and applications are put side-by-side, which allows the reader to gauge the strengths and weaknesses of different computational techniques.
Автор: J. Maruani; Christian Minot; R. McWeeny; Y.G. Smey Название: New Trends in Quantum Systems in Chemistry and Physics ISBN: 1402004125 ISBN-13(EAN): 9781402004124 Издательство: Springer Рейтинг: Цена: 18167.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: Based on the contributions to the fourth European Quantum Systems in Chemistry and Physics workshop held in Marly, France, in 1999. This volume covers topics such as: response theory, reactive collisions and chemical reactions and condensed matter.
Автор: P.J. Grout; Jean Maruani; Gerardo Delgado-Barrio; Название: Frontiers in Quantum Systems in Chemistry and Physics ISBN: 9048179610 ISBN-13(EAN): 9789048179619 Издательство: Springer Рейтинг: Цена: 36197.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: The basic theory of matter on the nanoscale is quantum mechanics and the application of quantum mechanics to the study of the many-body problem in molecules and materials is a rapidly developing field of research. This book defines the leading edge.
Автор: Alia Tadjer and Rossen Pavlov Название: Quantum systems in physics, chemistry, and biology. ISBN: 3319502549 ISBN-13(EAN): 9783319502540 Издательство: Springer Рейтинг: Цена: 30745.00 р. Наличие на складе: Поставка под заказ.
Описание: This book reviews the most significant developments in quantum methodology applied to a broad variety of problems in chemistry, physics, and biology.
Автор: Kiyoshi Nishikawa; Jean Maruani; Erkki J. Br?ndas; Название: Quantum Systems in Chemistry and Physics ISBN: 9400792875 ISBN-13(EAN): 9789400792876 Издательство: Springer Рейтинг: Цена: 58557.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание:
PART I. Fundamental Theory.- The Relativistic Kepler Problem and Gцdel's Paradox.- "The Dirac Electron: Spin, Zitterbewegung, the Compton Wavelength, and the Kinetic Foundation of Rest Mass".- Molecular Parity Violation and Chirality: the Asymmetry of Life and the Symmetry Violations of Physics.- PART II. Molecular Processes.- Application of Density Matrix Method to Ultrafast Processes.- Quantum Master Equation Study of Electromagnetically Induced Transparency in Dipole-Coupled Dimer Models.- Laser-Induced Electronic and Nuclear Coherent Motions in Chiral Aromatic Molecules.- Simulation of Nuclear Dynamics of C60: from Vibrational Excitation by Near-IR Femtosecond Laser Pulses to Subsequent Nanosecond Rearrangement and Fragmentation.- Systematics and Prediction in Franck-Condon Factors.- Electron Momentum Distribution and Atomic Collisions.- Ab initio Path Integral Molecular Dynamics: Simulations of F2H- and F2H+.- Relativistic Energy Approach to Cooperative Electron -Nuclear Processes: NEET Effect.- Advanced Relativistic Energy Approach to Radiative Decay Processes in Multielectron Atoms and Multicharged Ions.- PART III. Molecular Structure.- "Solving the Schrцdinger Equation for the Hydrogen Molecular Ion in a Magnetic Field using the Free-Complement Method".- Description of Core Ionized and Excited States by Density Functional Theory and Time-Dependent Density Functional Theory.- Intermolecular Potentials of the Carbon Tetrachloride and Trifluoromethane Dimers Calculated with Density Functional Theory.- Ab-initio study of the Potential Energy Surface and Stability of the Li2+(X2Σg+) Alkali Dimer in Interaction with the Xenon Atom.- Validation of Quantum Chemical Calculations for Sulfonamide Geometrical Parameters.- Approximate Spin Projection for Geometry Optimization of Biradical Systems - Case Studies of Through-Space and Through-Bond Systems.- PART IV. Molecular Properties.- DFT Calculations of the Hetero-Junction Effect for Precious Metal Cluster Catalysts.- Luminescence Wavelengths and Energy Level Structure of Binuclear Copper Complexes and Related Metal Complexes.- Valence XPS, IR, and Solution 13C NMR Spectral Analysis of Representative Polymers by Quantum Chemical Calculations.- PART V. Condensed Matter.- Quantum Decoherence at the Femtosecond Level in Liquids and Solids Observed in Neutron Compton Scattering.- Variational Path Integral Molecular Dynamics Study of Small Para-Hydrogen Clusters.- Origin of Antiferromagnetism in Molecular and Periodic Systems in the Original KohnSham Local Density Approximation.- Calculation of Magnetic Properties and Spectroscopic Parameters of Manganese Clusters with Density Functional Theory.- Density Functional Study of Manganese Complexes: Protonation Effects on Geometry and Magnetism.- Depth Profile Assignments of nm and mm Orders by Quantum Chemical Calculations for Chitosan Films Modified by Kr+ Beam Bombardment.- PART VI. Biosystems.- Color Tuning in Human Cone Visual Pigments: the Role of the Protein Environment.- Free Energy of Cell-Penetrating Peptide through Lipid Bilayer Membrane: Coarse-Grained Model Simulation.- Density Functional Study of the Origin of the Strongly Delocalized Electronic Structure of the CuA Site in Cytochrome c Oxidase.- The Potentials of the Atoms around Mg2+ in the H-ras GTP and GDP Complexes.- Molecular Dynamics Study of Glutathione S-Transferase: Structure and Binding Character of Glutathione.- Designing the Binding Surface of Proteins to Construct Nano-Fibers.
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