Diffusion Monte Carlo study of circular quantum dots

Citation
F. Pederiva et al., Diffusion Monte Carlo study of circular quantum dots, PHYS REV B, 62(12), 2000, pp. 8120-8125
Citations number
42
Categorie Soggetti
Apllied Physucs/Condensed Matter/Materiales Science
Journal title
PHYSICAL REVIEW B
ISSN journal
01631829 → ACNP
Volume
62
Issue
12
Year of publication
2000
Pages
8120 - 8125
Database
ISI
SICI code
0163-1829(20000915)62:12<8120:DMCSOC>2.0.ZU;2-E
Abstract
We present ground- and excited-state energies obtained from diffusion Monte Carlo (DMC) calculations, using accurate multiconfiguration wave functions , for N electrons (N less than or equal to 13) confined to a circular quant um dot. We compare the density and correlation energies to the predictions of local spin density approximation (LSDA) theory, and analyze the electron -electron pair-correlation functions. The DMC estimated change in electroch emical potential as a function of the number of electrons in the dot is com pared to that from LSDA and HF calculations. Hund's first rule is found to be satisfied for all dots except N = 4 for which there is a near degeneracy .