Harmonic inversion of semiclassical short time signals
Publikation: Beitrag in Fachzeitschrift › Forschungsartikel › Beigetragen › Begutachtung
Beitragende
- Albert-Ludwigs-Universität Freiburg
- University of Southern California
Abstract
The resonance parameters of the collinear H + H-2 system, calculated recently by the Lorentzian fit of Fourier spectra of the semiclassical time correlation function C(t), are here extracted directly by harmonic inversion of C(t) using the filter-diagonalization technique. The new approach reveals more resonances from a much shorter segment of the same signal C(t). This reduces both the semiclassical error and the overall numerical effort. (C) 1997 Elsevier Science B.V.
Details
Originalsprache | Englisch |
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Seiten (von - bis) | 355-360 |
Seitenumfang | 6 |
Fachzeitschrift | Chemical physics letters |
Jahrgang | 279 |
Ausgabenummer | 5-6 |
Publikationsstatus | Veröffentlicht - 21 Nov. 1997 |
Peer-Review-Status | Ja |
Externe IDs
Scopus | 0031582933 |
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Schlagworte
Schlagwörter
- FILTER-DIAGONALIZATION, TRANSITION-STATE, DYNAMICS, PROPAGATION, FREQUENCIES, RESONANCES