Advances in quantum methods and applications in chemistry, physics, and biology /
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. New trends and state-of-the-art developments...
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Corporate Authors: | ; |
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Group Author: | |
Published: |
Springer,
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Publisher Address: | Cham : |
Publication Dates: | 2013. |
Literature type: | eBook |
Language: | English |
Series: |
Progress in Theoretical Chemistry and Physics,
v.27 |
Subjects: | |
Online Access: |
http://dx.doi.org/10.1007/978-3-319-01529-3 |
Summary: |
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. New trends and state-of-the-art developments in the quantum theory of atomic and molecular systems, and condensed matter (including biological systems and nanostructures) are described by academics of international distinction. |
Item Description: | Includes index. |
Carrier Form: | 1 online resource (xv, 379 pages) : illustrations. |
ISBN: |
9783319015293 (electronic bk.) 331901529X (electronic bk.) |
Index Number: | QD462 |
CLC: | O641.12-532 |
Contents: |
Fundamental Theory. The Potential Energy Surface in Molecular Quantum Mechanics / A Comment on the Question of Degeneracies in Quantum Mechanics / The Dirac Electron as a Massless Charge Spinning at Light Speed: Implications on Some Basic Physical Concepts / Some Biochemical Reflections on Information and Communication / Molecular Structure, Properties and Processes. Application of the Uniformly Charged Sphere Stabilization for Calculating the Lowest 1 S Resonances of H - / Charge Transfer Rate Constants in Ion-Atom and Ion-Molecule Processes / Spin Torque and Zeta Force in Allene-Type Molecules / A Refined Quartic Potential Surface for S0 Formaldehyde / Operator Perturbation Theory for Atomic Systems in a Strong DC Electric Field / Clusters and Condensed Matter. Structural and Thermodynamic Properties of Au2-58 Clusters / An Evaluation of Density Functional Theory for CO Adsorption on Pt(111) / Hydrogen in Light-Metal Cage Assemblies: Towards a Nanofoam Storage / A Theoretical Study on a Visible-Light Photo-Catalytic Activity in Carbon-Doped SrTiO3 Perovskite / A Theoretical Study on Proton Conduction Mechanism in BaZrO3 Perovskite / Molecular Theory of Graphene / Topological Mechanochemistry of Graphene / Theoretical Analysis of Phase-Transition Temperature of Hydrogen-Bonded Dielectric Materials Induced by H/D Isotope Effect / On Converse Piezoelectricity / Structure and Processes in Biosystems. - Analysis of Water Molecules in the Hras-GTP and GDP Complexes with Molecular Dynamics Simulations / Bath Correlation Effects on Inelastic Charge Transport Through DNA Junctions / |