Big Chemical Encyclopedia

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

Articles Figures Tables About

Nuclear collisions

Magnetic fields are generated by the rotation of a molecular magnetic moment and modulated by molecular collisions. Nuclear spin interacts with the fluctuating magnetic field. [Pg.138]

D A Micha. Few-body processes in atom-diatom collisions. Nuclear Phys., A353 309c, 1981. [Pg.156]

S. Jonsell, A. Saenz, and P. Froelich. Low Energy Hydrogen - Antihydrogen Collisions. Nuclear Physics A, 663 959c, 2000. [Pg.202]

Library of Congress Cataloging in Publication Data. Christov, St. G. Collision theory and statistical theory of chemical reactions. (Lecture notes in chemistry 18) Bibliography p. Includes index. 1. Chemical reaction, Rate of. 2. Collisions (Nuclear physics) I. Title. QD502.K47 541.3 94 80-18112... [Pg.326]

Collisions (Nuclear physics) 2. Low temperatures. 3. Quantum solids. 4. Quantum liquids. 5. Coidgases. 6. Molecular dynamics. I. Krems, Roman. II. Friedrich, Bretislav. [Pg.707]

Solution of this set for F R) represents tire adiabatic close-coupling method. The adiabatic states are nomrally detennined (via standard computational teclmiques of quanUim chemistry) relative to a set of axes (X, Y, Z ) with the Z- axis directed along the nuclear separation R. On transfomring to this set which rotates during the collision, then /(r, / ), for the diatomic A-B case, satisfies... [Pg.2042]

The close-coupling equations are also applicable to electron-molecule collision but severe computational difficulties arise due to the large number of rotational and vibrational channels that must be retained in the expansion for the system wavefiinction. In the fixed nuclei approximation, the Bom-Oppenlieimer separation of electronic and nuclear motion pennits electronic motion and scattering amplitudes f, (R) to be detemiined at fixed intemuclear separations R. Then in the adiabatic nuclear approximation the scattering amplitude for ... [Pg.2051]

The interaction of a molecular species with electromagnetic fields can cause transitions to occur among the available molecular energy levels (electronic, vibrational, rotational, and nuclear spin). Collisions among molecular species likewise can cause transitions to occur. Time-dependent perturbation theory and the methods of molecular dynamics can be employed to treat such transitions. [Pg.375]

The first energy derivative is called the gradient g and is the negative of the force F (with components along the a center denoted Fa) experienced by the atomic centers F = -g. These forces, as discussed in Chapter 16, can be used to carry out classical trajectory simulations of molecular collisions or other motions of large organic and biological molecules for which a quantum treatment of the nuclear motion is prohibitive. [Pg.513]

Several further comparisons attest to the universal nature of the statistical fragmentation theory. In Fig. 8.28 the consequences of a nuclear fragmentation event brought about by the 70 MeV per nucleon collision of a carbon nucleus with a silver nucleus is shown (Greiner and Stocker, 1985). In this... [Pg.306]

In October 2006, a research team of scientists from the Lawrence Livermore National Laboratory in California, USA, and the Joint Institute of Nuclear Research in Dubna, Russia, reported the indirect detection of Uuo-294 (Element 118). It is reported to be produced by the following collisions. [Pg.515]

The quantity / is just a further combination of constants already in Eq. (10-70). The value of Z is taken to be the collision frequency between reaction partners and is often set at the gas-phase collision frequency, 1011 L mol-1 s-1. This choice is not particularly critical, however, since / is nearly unity unless is very large. Other authors29-30 give expressions for Z in terms of the nuclear tunneling factors and the molecular dimensions. [Pg.244]

An alternative to the traditional approach is to generate the electronic states as needed during the dynamics. This has been done for atomic collisions, where detailed calculations and comparisons with experimental results are possi-ble.(4-8) General treatments of the coupling of electronic and nuclear motions in molecular systems can be done in a variety of formulations. In particular, Ohrn, Deumens and collaborators have implemented a general variational treatment in... [Pg.318]

To properly describe electronic rearrangement and its dependence on both nuclear positions and velocities, it is necessary to develop a time-dependent theory of the electronic dynamics in molecular systems. A very useful approximation in this regard is the time-dependent Hartree-Fock approximation (34). Its combination with the eikonal treatment has been called the Eik/TDHF approximation, and has been implemented for ion-atom collisions.(21, 35-37) Approximations can be systematically developed from time-dependent variational principles.(38-41) These can be stated for wavefunctions and lead to differential equations for time-dependent parameters present in trial wavefunctions. [Pg.319]

Once the Fock operators have been constructed from a set of MSOs, this matrix equation is linear in its unknowns. Its coefficients are dependent on time in a way determined by the forces driving the electrons. These forces are the nuclear Coulomb potentials in molecular collisions or dynamics, but they could also be weak external fields. [Pg.331]


See other pages where Nuclear collisions is mentioned: [Pg.255]    [Pg.957]    [Pg.1080]    [Pg.1326]    [Pg.1828]    [Pg.1830]    [Pg.2456]    [Pg.2472]    [Pg.2473]    [Pg.2473]    [Pg.2975]    [Pg.3006]    [Pg.150]    [Pg.229]    [Pg.234]    [Pg.234]    [Pg.308]    [Pg.121]    [Pg.350]    [Pg.432]    [Pg.3]    [Pg.861]    [Pg.862]    [Pg.863]    [Pg.527]    [Pg.375]    [Pg.839]    [Pg.840]    [Pg.74]    [Pg.83]    [Pg.84]    [Pg.318]    [Pg.319]    [Pg.323]   
See also in sourсe #XX -- [ Pg.50 ]

See also in sourсe #XX -- [ Pg.50 ]




SEARCH



Electron nuclear dynamics , molecular systems, reactive collisions

Reactive collisions, electron nuclear dynamics

© 2024 chempedia.info