Big Chemical Encyclopedia

Chemical substances, components, reactions, process design ...

Articles Figures Tables About

Classical and

For complete information about books available from Penguin -including Pelicans, Puffins, Peregrines and Penguin Classics - and how to order them, write to us at the appropriate address below. Please note that for copyright reasons the selection of books varies from country to country. [Pg.437]

The above three sources are a classic and comprehensive treatment of rotation, vibration, and electronic spectra of diatomic and polyatomic molecules. [Pg.85]

Povodyrev et aJ [30] have applied crossover theory to the Flory equation ( section A2.5.4.1) for polymer solutions for various values of N, the number of monomer units in the polymer chain, obtaining the coexistence curve and values of the coefficient p jj-from the slope of that curve. Figure A2.5.27 shows their comparison between classical and crossover values of p j-j for A = 1, which is of course just the simple mixture. As seen in this figure, the crossover to classical behaviour is not complete until far below the critical temperature. [Pg.654]

Berne B J, Borkovec M and Straub J E 1988 Classical and modern methods in reaction rate theory J. Phys. Chem. 92 3711... [Pg.896]

Nitzan A 1988 Activated rate processes in condensed phases the Kramers theory revisited Adv. Chem. Phys. 70 489 Onuchic J N and Wolynes P G 1988 Classical and quantum pictures of reaction dynamics in condensed matter resonances, dephasing and all that J. Phys. Chem. 92 6495... [Pg.896]

Finally, in section A3. IT 6. scattering theory methods based on classical and semiclassical mechanics are described. [Pg.957]

Hase W L (ed) 1998 Comparisons of Classical and Quantum Dynamics (Adv. in Classical Trajectory Methods III) (Greenwich, CT JAI Press)... [Pg.1003]

Gutzwiller M C 1990 Chaos in Classical and Quantum Mechanics (New York Springer)... [Pg.1039]

Ciccotti G and Ferrario M 1998 Constrained and nonequilibrium molecular dynamics Classical and Quantum Dynamics In Condensed Phase Simulations ed B J Berne, G Ciccotti and D F Coker (Singapore World Scientific) pp 157-77... [Pg.2288]

Berne B J, Ciccotti G and Coker D F (ed) 1998 Classical and Quantum Dynamics In Condensed Phase S/mu/af/ons (Singapore World Scientific)... [Pg.2288]

Gaussian wavepackets are very special fiinctions which, in a sense, bridge the gap between classical and quantum... [Pg.2312]

To make connection between the spectra and tire ET process clearer, we note a simple model for tire lineshape that includes a classical and a high-frequency degree of freedom. In tliis case tire overall lineshape is... [Pg.2985]

Bala, P., Lesyng, B., McCammon, J.A. Application of quantum-classical and quantum-stochastic molecular dynamics simulations for proton transfer processes. Chem. Phys. 180 (1994) 271-285. [Pg.34]

Hence, as the second class of techniques, we discuss adaptive methods for accurate short-term integration (Sec. 4). For this class, it is the major requirement that the discretization allows for the stepsize to adapt to the classical motion and the coupling between the classical and the quantum mechanical subsystem. This means, that we are interested in discretization schemes which avoid stepsize restrictions due to the fast oscillations in the quantum part. We can meet this requirement by applying techniques recently developed for evaluating matrix exponentials iteratively [12]. This approach yields an adaptive Verlet-based exponential integrator for QCMD. [Pg.397]

Cramer C J and Truhlar D G 1995. Continuum Solvation Models Classical and Quantum Mechanical Implementations. In Lipkowitz K B and D B Boyd (Editors) Reviews in Computational Chemistry Volume 6. New York, VCH Publishers, pp. 1-72. [Pg.648]

Figure 9.2. Carbon Is photoelectron spectrum Is core-hole-state spectra for the 2-norbornyl cation of tert-butyl cation and Clark s simulated spectra for the classical and nonclassical ions. Figure 9.2. Carbon Is photoelectron spectrum Is core-hole-state spectra for the 2-norbornyl cation of tert-butyl cation and Clark s simulated spectra for the classical and nonclassical ions.

See other pages where Classical and is mentioned: [Pg.198]    [Pg.6]    [Pg.7]    [Pg.459]    [Pg.484]    [Pg.658]    [Pg.664]    [Pg.871]    [Pg.878]    [Pg.880]    [Pg.994]    [Pg.994]    [Pg.1000]    [Pg.1013]    [Pg.1027]    [Pg.2310]    [Pg.2451]    [Pg.2863]    [Pg.73]    [Pg.102]    [Pg.7]    [Pg.387]    [Pg.396]    [Pg.402]    [Pg.158]    [Pg.246]    [Pg.248]    [Pg.156]    [Pg.148]    [Pg.215]    [Pg.158]    [Pg.246]   


SEARCH



A Classical and Pictorial Approach

Canonical transformations and classical mechanics

Classic Entry and Spreading Coefficients

Classic and Advanced Ceramics: From Fundamentals to Applications. Robert B. Heimann

Classic and Advanced Ceramics: From Fundamentals to Applications. Robert B. Heimann 2010 WILEY-VCH Verlag GmbH Co. KGaA, Weinheim

Classical Books and Review Articles in Physical Organic Chemistry

Classical Fluctuation Path and Connected Green Function

Classical Lagrangian and Hamiltonian

Classical Methods and Their Development

Classical Model and Theory

Classical Particle Mechanics and Vibration

Classical Photon Detectors Simple Photoconductor and Photovoltaics

Classical Rh and Pt Phosphines Catalyst Precursors

Classical Spectrophotometric Analysis, Limitations, and Early Attempts to Find a Solution

Classical Theory of Diffusion and Seepage Problems in Porous Media

Classical and Chemical Thermodynamics

Classical and Quantum Mechanics in the Theory of Charged-Particle Stopping

Classical and Symbolic Logic

Classical and quantum Hall effects

Classical and quantum mechanics

Classical and quantum potentials

Classical and quantum worlds

Classical cloning, expression, and purification

Classical gene cloning and identification

Classical ideal gas and the Poisson distribution

Classical renormalization and the Dirac equation

Classical statistical mechanics of dense gases and liquids

Classical velocity and zitterbewegung

Classics In Total Synthesis of Oligosaccharides and Glycoconjugates

Classics in Stereoselective Synthesis. Erick M. Carreira and Lisbet Kvaerno

Classification of individuals and concepts CLASSIC)

Comparison Between Classical and Green Designs

Contrast between Classical and Modern Chemical Routes

Cooperative and Anticooperative Energy Effects in Systems with Classical Hydrogen Bonds

Density functional and classic integral equation theories

Dissociation enthalpies from classical and nonclassical calorimetric studies

Drop Model and Classical Nucleation Theory

Dynamics of Quantized Particles and Classical Light Fields

E Chemical Processes and Classical Thermodynamics

Electric and magnetic interactions. The classical approach

Elements of Classical Mechanics and Electrodynamics

Energy and momentum in classical electrodynamics

Entropy produced in classical and green designs

Hansch Analysis and Classical QSAR

Introduction The Merger of Classical Mechanics and Probability Theory

Laminate plate and shell stiffness classical lamination theory (CLT)

Modifications of the Classical Theory and More Rigorous Approaches

NO2 and dust Classic for local to regional up-scaling

Navier-Stokes Equation and the Classical Permeability Theory

Phase spaces, from classical to quantum mechanics, and back

Possibilities in classical and modern biotechnology

Quantum and Classical

Quantum and Classical Degrees of Freedom Proton Transfer

Quantum and classical probability

Rationalizing the Biodegradation of Glasses for Biomedical Applications Through Classical and Ab-initio Simulations

Semi-classical Expansion and the WKB Approximation

Some Classical and Emerging Experimental Tools

Some Examples of Differential Equations Arising in Classical and Chemical Contexts

Statistical and Classical Entropy

Structural evidence against the classical through resonance concept in p-nitroaniline and its derivatives

Substrate and Product Concentration in Enzymes Following Classical Michaelis-Menten Kinetics

The Classical Approach Vibrational and Nonbonded (Force Field) Energies

The Rise and Fall of Classical VB Theory

Transport Coefficients of Quantum-Classical Systems Kapral and G. Ciccotti

Two Classical Limits—Tight Binding and Nearly Free Electron

Types of Photoemissive Surfaces Classical and NEA

Water Purification Processes Classical and Modern

© 2024 chempedia.info