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Updated: Feb 26, 2026

Excitonic Hamiltonians for Calculating Optical Absorption Spectra and Optoelectronic Properties of Molecular Aggregates and Solids
Published on: May 27, 2020
Diffusion Monte Carlo study of excitons and biexcitons in a mass-asymmetric electron-hole bilayer
Rajesh O Sharma1, L K Saini, Bhagwati Prasad Bahuguna
1Applied Physics Department, Sardar Vallabhbhai National Institute of Technology Surat, 395007, India. drlalitsaini75@gmail.com.
Abstract:
We employed the diffusion Monte Carlo method, under fixed node approximation, to investigate the various ground state properties of a mass-asymmetric electron-hole bilayer system. Particularly, we calculated the ground state energy, the condensation fraction c, and the pair correlation function g(r) at density rs = 5 a.u. for the inter-planer distance d ≤ 0.5 a.u. Based on the characteristics of condensate faction and pair correlation functions, we found the phase transition from the excitonic fluid phase to the biexcitonic fluid phase at d = 0.24 a.u. We also analytically calculated the critical layer separation dcrit for biexciton stability, the value for which was almost double the d = 0.24 a.u.
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