Exploring quantum confinement signature in nitrogen-functionalized graphene quantum dots: Effective mass approximation (EMA) model insights from computational and experimental analyses

Closed

Fitri Aulia Permatasari, Reza Umami, Tirta Rona Mayangsari, Euis Sustini, Akfiny Hasdi Aimon, Fatimah Arofiati Noor, Dian Ahmad Hapidin, Neni Surtiyeni, Ferry Iskandar, Khairurrijal Khairurrijal

2024 Materials Science in Semiconductor Processing Vol. 182 Article Cited by 10 Quartile

Abstract

A well-established relationship between bandgap energy and Quantum Dots (QDs) dimension, predicted by Effective Mass Approximation (EMA) models, is a cost-effective and reliable method to evaluate the bandgap energy of QDs. The EMA model sheds light on linearity between bandgap energy (Egap) to their inverse square diameter (1/dn), as a signature of the quantum confinement, with the n value reflecting the dimension of the quantum confinement. This study systematically investigated the power parameter “n” dependence in the bandgap energy of Nitrogen-functionalized Graphene Quantum Dots (N-GQDs) with distinct C–N configurations, i.e., Pyridinic-N, Pyrrolic-N, Graphitic-N based on computational and experimental data. The results showed that the calculated bandgap energy values reveal a notable weakening of the size dependence in N-GQDs compared to pristine GQDs, particularly in Pyrrolic-N GQDs, indicative of a unique geometric dimensionality of confinement. This systematic exploration advances our understanding of “n” dependence and bandgap energy in N-GQDs, laying a solid groundwork for modulating the bandgap energy of N-GQDs for optoelectronics and quantum device applications. © 2024 Elsevier Ltd

Affiliations

Department of Physics, Faculty of Mathematics and Natural Sciences, Institut Teknologi Bandung, Jalan Ganesha 10, West Java, Bandung, 40132, Indonesia; Research Center for Nanosciences and Nanotechnology, Institut Teknologi Bandung, Jalan Ganesha 10, Bandung, 40132, Indonesia; Collaboration Research Center for Advanced Energy Materials, National Research and Innovation Agency - Institut Teknologi Bandung, Jalan Ganesha 10, West Java, Bandung, 40132, Indonesia; Department of Chemistry, Universitas Pertamina, Jakarta, 12220, Indonesia; Center for Green and Sustainable Materials, Institut Teknologi Sumatera, Jalan Terusan Ryacudu, Way Huwi, Lampung, 35365, Indonesia; Department of Physics, Faculty of Science, Institut Teknologi Sumatera, Jalan Terusan Ryacudu, Way Huwi, Lampung, 35365, Indonesia