Density functional theory-accelerated design of perovskite quantum dots: unlocking atomic-level control for next-generation optoelectronics and sensors
Year: 2026
Type: article
Abstract: conversion under strain. These predictive insights-validated across LEDs, photodetectors, and sensors-establish DFT as a high-throughput engine for designing stable, defect-tolerant, and compositionally tunable PQDs, providing the most comprehensive DFT-driven framework to date for both lead-halide and emerging lead-free perovskite quantum dot technologies.
Source: RSC Advances
DOI: 10.1039/d5ra08558f
Institutions: Al-Ahliyya Amman University, Al-Zahrawi University, Jain University, Siksha O Anusandhan University, Institute of Medical Sciences and Sum Hospital, Al Noor University College, Sathyabama Institute of Science and Technology, Sharda University, Chandigarh University, Islamic Azad University, Tehran
Language: English
Subfield: Electrical and Electronic Engineering
Field: Engineering
Domain: Physical Sciences
Open Access status: gold
Estimated APC paid: $1,042
OpenAlex ID: W7118408388