Quantum and semiclassical theories of chemical reaction rates [electronic resource].
- Washington, D.C. : United States. Dept. of Energy, 1995.
Oak Ridge, Tenn. : Distributed by the Office of Scientific and Technical Information, U.S. Dept. of Energy.
- Physical Description:
- 21 pages : digital, PDF file
- Additional Creators:
- Lawrence Berkeley National Laboratory, United States. Department of Energy, and United States. Department of Energy. Office of Scientific and Technical Information
- Restrictions on Access:
- Free-to-read Unrestricted online access
- A rigorous quantum mechanical theory (and a semiclassical approximation thereto) is described for calculating chemical reaction rates ``directly``, i.e., without having to solve the complete state-to-state reactive scattering problem. The approach has many vestiges of transition state theory, for which it may be thought of as the rigorous generalization.
- Report Numbers:
- E 1.99:lbl--37814
E 1.99: conf-9511139--1
- Other Subject(s):
- Published through SciTech Connect.
20. international Solvay conference in chemistry, Brussels (Belgium), 28 Nov - 2 Dec 1995.
- Funding Information:
View MARC record | catkey: 14355910