CORRELATION-EFFECTS IN A FEW-PARTICLE ONE-DIMENSIONAL COULOMB-INTERACTING SYSTEM

Citation
S. Olszewski et al., CORRELATION-EFFECTS IN A FEW-PARTICLE ONE-DIMENSIONAL COULOMB-INTERACTING SYSTEM, Theoretica Chimica Acta, 95(5-6), 1997, pp. 165-200
Citations number
141
Categorie Soggetti
Chemistry Physical
Journal title
ISSN journal
00405744
Volume
95
Issue
5-6
Year of publication
1997
Pages
165 - 200
Database
ISI
SICI code
0040-5744(1997)95:5-6<165:CIAFOC>2.0.ZU;2-G
Abstract
A model of the one-dimensional Coulomb-interacting few-particle system is studied in detail. The model is similar to a many-electron system which in a zero-order approximation of the non-interacting particles h as only singly occupied one-electron levels. Such model cancels the di vergencies in the Coulomb and exchange interaction energies found regu larly for a conventional one-dimensional system which is built up of t he doubly occupied one-electron levels and is submitted to the Coulomb perturbation. In the present case, the correlated wave functions for the system can be obtained from the Slater determinants constructed fo r the sets of the one-electron levels and combined according to the ru les given by the standard perturbation theory. The calculations allow us to discuss the correlation influence and the effect of the size of the model on: (i) the excitation energies including the criterion corr esponding to the metal-insulator transition (the Mott transition), (ii ) the distribution of the correlated charge along the model, (iii) the average velocity of a two-particle system being in different states, and (iv) the dipole moments and transition probabilities. In the last case, the lifetime of the uncorrelated and correlated excited states o btained in the situation of the allowed one-photon transitions can be compared with the lifetime obtained for a similar system in the case w hen the one-photon transitions are forbidden and two-photon transition s should be taken into account. No data other than the length of the m odel and the fundamental constants of nature enter the calculations.