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Shaun Tan

Publications and source records attributed to Shaun Tan.

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Benchmarking LLM Summaries of Multimodal Clinical Time Series for Remote Monitoring

Large language models (LLMs) can generate fluent clinical summaries of remote therapeutic monitoring time series. However, it remains unclear whether these narratives faithfully capture clinically significant events, such as sustained abnormalities. Existing evaluation metrics primarily focus on semantic similarity and linguistic quality, leaving event-level correctness largely unmeasured. To address this gap, we introduce an event-based evaluation framework for multimodal time-series summarization using the Technology-Integrated Health Management (TIHM)-1.5 dementia monitoring dataset. Clinically grounded daily events are derived through rule-based abnormal thresholds and temporal persistence criteria. Model-generated summaries are then aligned with these structured facts. Our evaluation protocol measures abnormality recall, duration recall, measurement coverage, and hallucinated event mentions. We benchmark three approaches: zero-shot prompting, statistical prompting, and a vision-based pipeline that uses rendered time-series visualizations. The results reveal a striking decoupling between conventional metrics and clinical event fidelity. Models that achieve high semantic similarity scores often exhibit near-zero abnormality recall. In contrast, the vision-based approach demonstrates the strongest event alignment, achieving 45.7% abnormality recall and 100% duration recall. These findings underscore the importance of event-aware evaluation to ensure reliable clinical time-series summarization.

cs.AI

Single-Emitter Spectra from an Ensemble

The heterogeneity in nanoscale emitters hinders efforts to understand their basic photophysics and limits their use in practical applications. Existing methods have difficulty accurately characterizing single-emitter spectra and optical heterogeneity on a statistical scale. Here, we introduce SPICEE (SPectrally Imbalanced Correlations from Ensemble Emission), a spectrally filtered photon-correlation technique that recovers single-particle emission lineshapes from an ensemble sample. Analytical derivations, numerical modeling, and experiments on a solution ensemble of emitters validate the technique. We apply SPICEE to blue-emitting ZnSeTe semiconductor nanocrystals relevant to display applications and find that the low color purity in the ensemble spectrum is primarily caused by a small subpopulation of nanocrystals with a distinct emission mechanism. This work demonstrates that SPICEE is a powerful high-throughput tool for accurately characterizing the single-emitter properties of nanoscale systems.

cond-mat.mes-hall

A closed-loop AI framework for hypothesis-driven and interpretable materials design

Scientific hypothesis generation is central to materials discovery, yet current approaches often emphasize either conceptual (idea-to-data) reasoning or data-driven (data-to-idea) analysis, rarely achieving an effective integration of both. Here, we present a generalizable active learning workflow that integrates top-down, theory-driven hypothesis generation, guided by a large language model. This is complemented by bottom-up, data-driven hypothesis testing through a root-cause association study. We demonstrate this approach through the design of equimolar quinary-cation two-dimensional perovskite, a chemically complex system with over 850,000 possible cation combinations. In the top-down component, the large language model drives closed-loop optimization by proposing candidates that are likely to achieve phase purity, leveraging domain knowledge and chain-of-thought reasoning. With each iteration, the model identifies an increasing number of near phase-pure compositions, sampling less than 0.004% of the design space. In parallel, the bottom-up association study identifies molecular features with statistically significant influences on phase purity. The integration of these approaches enables the convergence of conceptual and statistical hypotheses, leading to generalizable and rational design rules for phase-pure quinary-cation two-dimensional perovskites. As a proof of concept, we applied the optimized phase-pure quinary-cation two-dimensional perovskite film as a surface capping layer in perovskite solar cells, achieving good performance and stability. Our framework enables the development of interpretable and generalizable design rules that are applicable to a wide range of optimization processes within complex design spaces, providing a foundational strategy for rational, scalable, and efficient materials discovery.

cond-mat.mtrl-sci

Morphological and Chemical Changes in Cd-free Colloidal QD-LEDs During Operation

Heavy metal-free quantum-dot light-emitting devices (QD-LEDs) have demonstrated remarkable brightness, saturated color, and high efficiencies across a broad spectral range. However, in contrast to organic LEDs (OLEDs), QD-LED operational lifetimes remain limited, with the underlying degradation mechanisms not fully understood. In the present study, we show that InP/ZnSe/ZnS (red-emitting) and ZnTeSe/ZnSe/ZnS (blue-emitting) cadmium-free colloidal QD-LEDs undergo nanoscale morphological changes during operation. Specifically,interparticle coarsening and layer thinning are observed in the electron transport layer (ETL) consisting of ZnMgO nanoparticles (NPs), in the QD emissive layer, and in the organic hole transport layer. This is accompanied by the generation and diffusion of compositional oxygen- and hydrogen-radicals throughout the device, with oxygen accumulating at the electrode/ETL interfance. Moreover, in situ transmission electron microscopy reveals the electron beam exposure, in the presence of hydrogen radicals, accelerates ZnMgO NPs coarsening. To mitigate these degradation pathway, we show that acrylate-based resin-encapsulation treatment stabilize the ETL/QD layers by suppressing the radical formation and halting morphology changes. This approach achieves dramatic stability enhancements, exhibits an 8-fold and 5000-fold lifetime improvement on InP/ZnSe/ZnS and ZnTeSe/ZnSe/ZnS QD-LEDs, respectively. Our findings establish the causal relationships between the morphological degradation, interlayer radical dynamics, and state-of-the-art QD-LEDs instability, providing new insights into a scalable encapsulation treatment that enables efficient and long-lived Cd-free QD-LEDs.

physics.app-ph

Oxygen vacancy formation in ZnSeTe blue quantum dot light-emitting diodes

Recent advancements have led to the development of bright and heavy metal-free blue-emitting quantum dot light-emitting diodes (QLEDs). However, consensus understanding of their distinct photophysical and electroluminescent dynamics remains elusive. This work correlates the chemical and electronic changes occurring in a QLED during operation using depth-resolved and operando techniques. The results indicate that oxygen vacancy forms in the ZnMgO layer during operation, with important implications on the charge injection and electrochemical dynamics. Taken together, the results suggest a causal relationship between oxygen vacancy formation and operational degradation of the blue-emitting ZnSeTe-based QLEDs.

physics.chem-ph

Predicting Organic-Inorganic Halide Perovskite Photovoltaic Performance from Optical Properties of Constituent Films through Machine Learning

We demonstrate a machine learning (ML) approach that accurately predicts the current-voltage behavior of 3D/2D-structured (FAMA)Pb(IBr)3/OABr hybrid organic-inorganic halide perovskite (HOIP) solar cells under AM1.5 illumination. Our neural network algorithm is trained on measured responses from several hundred HOIP solar cells, using three simple optical measurements of constituent HOIP films as input: optical transmission spectrum, spectrally-resolved photoluminescence, and time-resolved photoluminescence, from which we predict the open-circuit voltage (Voc), short-circuit current (Jsc), and fill factors (FF) values of solar cells that contain the HOIP active layers. Determined average prediction accuracies for 95 % of the predicted Voc, Jsc, and FF values are 91%, 94% and 89%, respectively, with R2 coefficients of determination of 0.47, 0.77, and 0.58, respectively. Quantifying the connection between ML predictions and physical parameters extracted from the measured HOIP films optical properties, allows us to identify the most significant parameters influencing the prediction results. With separate ML-classifying algorithms, we identify degraded solar cells using the same optical input data, achieving over 90% classification accuracy through support vector machine, cross entropy loss, and artificial neural network algorithms. To our knowledge, the demonstrated regression and classification work is the first to use ML to predict device photovoltaic properties solely from the optical properties of constituent materials.

cond-mat.mtrl-sci

Handshakes AI Research at CASE 2021 Task 1: Exploring different approaches for multilingual tasks

The aim of the CASE 2021 Shared Task 1 (H\"urriyeto\u{g}lu et al., 2021) was to detect and classify socio-political and crisis event information at document, sentence, cross-sentence, and token levels in a multilingual setting, with each of these subtasks being evaluated separately in each test language. Our submission contained entries in all of the subtasks, and the scores obtained validated our research finding: That the multilingual aspect of the tasks should be embraced, so that modeling and training regimes use the multilingual nature of the tasks to their mutual benefit, rather than trying to tackle the different languages separately. Our code is available at https://github.com/HandshakesByDC/case2021/

cs.CL