화학공학소재연구정보센터
Chemical Physics Letters, Vol.689, 116-120, 2017
Shannon information entropy in position space for doubly excited states of helium with finite confinements
Quantifying electron localization in quantum confined systems remains challenging, especially for excited states. A quantum dot (QD) is represented by a helium atom in a finite oscillator potential. The effect of dot width variation on the electron localization in QD is systematically examined via Shannon entropy for low-lying doubly excited states (2s(2) S-1(e), 2p(2) S-1(e), 2s3s S-1(e)) obtained using highly correlated Hylleraas functions. In particular, the most effective dot width where the electron density is the most localized is determined successfully and justified by the electron density plot for all three states. (C) 2017 Elsevier B.V. All rights reserved.