Predicting Photoluminescence Quantum Yields of Quantum Dots from Time-Resolved Photoluminescence with Artificial Neural Networks

Photoluminescence (PL) dynamics of quantum dots (QDs) are indicative of the quality of the emission channel, band-edge emission from a delocalized excitonic state, or emission from a localized state. PL dynamics determine the PL quantum yield (QY), although the quantitative relationship between the two is not always easy to establish, especially for heterogeneous ensembles of QDs. In this work, we develop a generalized artificial neural network (ANN) model that makes use of a combination of physical characteristics and measured transient PL to predict the QY of QD samples of various compositions. We train the model using literature and our own data for QDs of a number of compositions (CdSe, CdTe, PbS). We deploy the model on new validation data points as well as compositions not used in training (Cd3P2). We observe a solid performance of the model on the validation set, with a root-mean-square error of 13%. Finally, we use the trained model to make predictions of radiative lifetimes of QDs of several compositions.

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Publication Details

Journal
The Journal of Physical Chemistry C
Published
2026-04-01
DOI
https://doi.org/10.1021/acs.jpcc.5c06557
Primary Topic
Quantum Dots Synthesis And Properties
Type
article
Field-Weighted Citation Impact
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article

Predicting Photoluminescence Quantum Yields of Quantum Dots from Time-Resolved Photoluminescence with Artificial Neural Networks

Igor Fedin, Logan Smith, Taela Brown, Adeyemi Michael Adeboyejo et al.
The Journal of Physical Chemistry C
Quantum Dots Synthesis And Properties
article

Predicting Photoluminescence Quantum Yields of Quantum Dots from Time-Resolved Photoluminescence with Artificial Neural Networks

Igor Fedin, Logan Smith, Taela Brown, Adeyemi Michael Adeboyejo, Sadia Jannat
article en

Abstract

Photoluminescence (PL) dynamics of quantum dots (QDs) are indicative of the quality of the emission channel, band-edge emission from a delocalized excitonic state, or emission from a localized state. PL dynamics determine the PL quantum yield (QY), although the quantitative relationship between the two is not always easy to establish, especially for heterogeneous ensembles of QDs. In this work, we develop a generalized artificial neural network (ANN) model that makes use of a combination of physical characteristics and measured transient PL to predict the QY of QD samples of various compositions. We train the model using literature and our own data for QDs of a number of compositions (CdSe, CdTe, PbS). We deploy the model on new validation data points as well as compositions not used in training (Cd3P2). We observe a solid performance of the model on the validation set, with a root-mean-square error of 13%. Finally, we use the trained model to make predictions of radiative lifetimes of QDs of several compositions.

The Journal of Physical Chemistry CVol. 130(15)
University of Alabama (US)
Openalex Percentile: Top 28%
Quantum Dots Synthesis And Properties
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Predicting Photoluminescence Quantum Yields of Quantum Dots from Time-Resolved Photoluminescence with Artificial Neural Networks — Igor Fedin, Logan Smith, et al. · The Journal of Physical Chemistry C (2026) | TGRS Research Map | TGRS