Panoramic analysis of 2D dirubidium telluride monolayer benchmarking the DFT approach

Panoramic analysis of 2D dirubidium telluride monolayer benchmarking the DFT approach

Abstract Through the DFT computations, the structural, vibrational, electronic, elastic, optical and thermal (thermoelectric, thermodynamic) properties of the two-dimensional Rb2Te monolayer are briefly contemplated. The Perdew-Bruke-Ernzerhof (PBE) form of generalized gradient approximation (GGA) f...

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Bibliographic Details
Main Authors: G. Sneha, R. D. Eithiraj
Format: Article
Language:English
Published: Nature Portfolio 2025-02-01
Series:Scientific Reports
Subjects:
Two-dimensional materials
Density functional theory
Material properties
Rb2Te monolayer
Optoelectronic
Thermoelectric
Online Access:https://doi.org/10.1038/s41598-025-89149-z
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https://doi.org/10.1038/s41598-025-89149-z

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