Diffusion Monte Carlo study of circular quantum dots

Article

关键词: DENSITY-FUNCTIONAL THEORY;    MAGNETIC-FIELD;    CAPACITANCE SPECTROSCOPY;    ARTIFICIAL ATOMS;    WAVE-FUNCTIONS;    ELECTRONS;    SINGLE;    SYMMETRY;    SPECTRA;    STATES;   

DOI  :  10.1103/PhysRevB.62.8120

来源: SCIE

【 摘 要 】

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 quantum 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 electrochemical potential as a function of the number of electrons in the dot is compared 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.

【 授权许可】

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