In this work, we propose an efficient method of reducing the computational effort of variational calculation with a Hylleraas-like trial wavefunction. The method consists of introducing integral transforms for the ter...In this work, we propose an efficient method of reducing the computational effort of variational calculation with a Hylleraas-like trial wavefunction. The method consists of introducing integral transforms for the terms as r12^κ exp （-λτ12） which provide the calculation of the expectation value of energy and the relevant matrix elements to be done analytically over single-electron coordinates instead of Hylleraas coordinates. We have used this method to calculate the ground state energy of a two-electron system in a spherical dot and a disk-like quantum dot separately. Under parabolic confinement potential and within effective mass approximation size and shape effects of quantum dots on the ground state energy of two electrons have been investigated. The calculation shows that our results even with a small number of basis states are in good agreement with previous theoretical results.展开更多
基金supported by the Cumhuriyet University,National MOVPE Crystal Growth and Characterization Laboratory,Turkey,DPT-K 120,TUBITAK (Grant Nos TBAG 105T492,TBAG 107T012,and TBAG-108T015)
文摘In this work, we propose an efficient method of reducing the computational effort of variational calculation with a Hylleraas-like trial wavefunction. The method consists of introducing integral transforms for the terms as r12^κ exp （-λτ12） which provide the calculation of the expectation value of energy and the relevant matrix elements to be done analytically over single-electron coordinates instead of Hylleraas coordinates. We have used this method to calculate the ground state energy of a two-electron system in a spherical dot and a disk-like quantum dot separately. Under parabolic confinement potential and within effective mass approximation size and shape effects of quantum dots on the ground state energy of two electrons have been investigated. The calculation shows that our results even with a small number of basis states are in good agreement with previous theoretical results.
