An edition of Quantum Systems in Chemistry and Physics (2012)

Quantum Systems in Chemistry and Physics

Progress in Methods and Applications

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An edition of Quantum Systems in Chemistry and Physics (2012)

Quantum Systems in Chemistry and Physics

Progress in Methods and Applications

by

  • ★★★★ 4.00 ·
  • 1 Rating
  • 0 Want to read
  • 0 Currently reading
  • 1 Have read

Quantum Systems in Chemistry and Physics: Progress in Methods and Applications is a collection of 33 selected papers from the scientific contributions presented at the 16th International Workshop on Quantum Systems in Chemistry and Physics (QSCP-XVI), held at Ishikawa Prefecture Museum of Art in Kanazawa, Japan, from September 11th to 17th, 2011.
The volume discusses the state of the art, new trends, and the future of methods in molecular quantum mechanics and their applications to a wide range of problems in physics, chemistry, and biology. The breadth and depth of the scientific topics discussed during QSCP-XVI appears in the classification of the contributions in six parts:

I. Fundamental Theory
II. Molecular Processes
III. Molecular Structure
IV. Molecular Properties
V. Condensed Matter
VI. Biosystems.

Quantum Systems in Chemistry and Physics: Progress in Methods and Applications is written for advanced graduate students as well as for professionals in theoretical chemical physics and physical chemistry. The book covers current scientific topics in molecular, nano, material, and bio sciences and provides insights into methodological developments and applications of quantum theory in physics, chemistry, and biology that have become feasible at end of 2011.

Publish Date
Publisher
Springer Netherlands, Imprint: Springer
Language
English
Pages
572

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Previews available in: English

Subjects
Quantum theory, Condensed Matter Physics, Physical organic chemistry, Theoretical and Computational Chemistry, Chemistry, Physical and theoretical Chemistry, Quantum chemistry

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Cover of: Quantum Systems in Chemistry and Physics
Quantum Systems in Chemistry and Physics: Progress in Methods and Applications
Jan 28, 2015, Ingramcontent, Springer
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Cover of: Quantum Systems in Chemistry and Physics
Quantum Systems in Chemistry and Physics: Progress in Methods and Applications
2012, Springer
in English
Libraries near you: WorldCat
Cover of: Quantum Systems in Chemistry and Physics
Quantum Systems in Chemistry and Physics: Progress in Methods and Applications
2012, Springer Netherlands, Imprint: Springer
electronic resource : in English
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Book Details

Table of Contents

<p>PART I. Fundamental Theory
The Relativistic Kepler Problem and Gödel’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 Schrödinger 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 KohnSham 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.</p>.
^^

Edition Notes

Published in
Dordrecht
Series
Progress in Theoretical Chemistry and Physics -- 26

Classifications

Dewey Decimal Class
541.2
Library of Congress
QD450-801

The Physical Object

Format
[electronic resource] :
Pagination
XXI, 572 p. 192 illus., 68 illus. in color.
Number of pages
572

ID Numbers

Open Library
OL27084165M
Internet Archive
quantumsystemsch00brnd
ISBN 13
9789400752979

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Internet Archive item record
Internet Archive item record
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February 26, 2022 Edited by ImportBot import existing book
July 6, 2019 Edited by MARC Bot import existing book
July 6, 2019 Created by MARC Bot Imported from Internet Archive item record