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CALCULATING THE POSITRON – ELECTRON CORRELATION ENERGY IN ZnO WITH THE MODIFIED SINGLE WAVE FUNCTION FOR POSITRON

Tao Van Chau 1, *
Lang Hoa Trinh 1
Tuan Anh Nguyen 2
Chien Hoang Le 1
Loc Huu Nguyen 1
  1. University of Science
  2. Research and Development Center for Radiation Technology
Correspondence to: Tao Van Chau, University of Science. Email: pvphuc@hcmuns.edu.vn.
Volume & Issue: Vol. 14 No. 4 (2011) | Page No.: 77-85 | DOI: 10.32508/stdj.v14i4.2029
Published: 2011-12-30

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Copyright The Author(s) 2023. This article is published with open access by Vietnam National University, Ho Chi Minh city, Vietnam. This article is distributed under the terms of the Creative Commons Attribution License (CC-BY 4.0) which permits any use, distribution, and reproduction in any medium, provided the original author(s) and the source are credited. 

Abstract

The ZnO – positron system is studied and its positron – electron correlation energy is estimated in its ground state. The positron binds with the outer shell electrons of Zinc and Oxigen to form the pseudo ZnO – positron molecule before it anihilates with one of these electrons. In this work, the single wave function for positron is modified according to the principle of linear superposition, and by using Variational Quantum Monte – Carlo method (VQMC) the correlation energy of this system is estimated with the value Ec e-p = - 9.3 ± 1.1 eV. It turns out that the value is closer to results estimated by other methods than the value that we had done before.

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