Evidence map›Paper›PMID 42401581›Full record

ArticleNature communications2026

Octahedral-motif-guided design of optoelectronic semiconductors via interpretable machine learning.

Xiaoyu Yang, Wenyue Zhao, Xin He, Weidong Fei, Yuanhui Sun, Yu Zhao, Lijun Zhang

Abstract read
In one paragraph

Article in Nature communications, 2026. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.

0numbers the graph read from it
0cells of the map it votes in
0citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

0 citing papers in PubMed.

No citing paper in PubMed yet.

4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

7 authors.

Xiaoyu Yang *State Key Laboratory of Integrated Optoelectronics, Key Laboratory of Material Simulation Methods & Software of MOE, College of Materials Science and Engineering, Jilin University, Changchun, PR China.ORCID http://orcid.org/0009-0005-3969-4139
Wenyue Zhao *School of Physics, Harbin Institute of Technology, Harbin, PR China.
Xin HeState Key Laboratory of Integrated Optoelectronics, Key Laboratory of Material Simulation Methods & Software of MOE, College of Materials Science and Engineering, Jilin University, Changchun, PR China.
Weidong FeiSchool of Materials Science and Engineering, Harbin Institute of Technology, Harbin, PR China.ORCID http://orcid.org/0000-0002-8380-5722
Yuanhui SunSuzhou National Laboratory, Suzhou, PR China. sunyh@szlab.ac.cn.ORCID http://orcid.org/0000-0003-2981-1133
Yu ZhaoSchool of Physics, Harbin Institute of Technology, Harbin, PR China. yuzhao@hit.edu.cn.ORCID http://orcid.org/0000-0003-1286-1978
Lijun ZhangState Key Laboratory of Integrated Optoelectronics, Key Laboratory of Material Simulation Methods & Software of MOE, College of Materials Science and Engineering, Jilin University, Changchun, PR China. lijun_zhang@jlu.edu.cn.ORCID http://orcid.org/0000-0002-6438-5486

Funding

National Natural Science Foundation of China (National Science Foundation of China) 12504021National Natural Science Foundation of China (National Science Foundation of China) 62125402National Natural Science Foundation of China (National Science Foundation of China) 62321166653National Natural Science Foundation of China (National Science Foundation of China) T2521005
6 · The paper itself

Abstract

Halide perovskites' remarkable optoelectronic properties stem from their metal halide octahedra. This connection underscores the promise of systematically extracting the physical rules encoded in octahedral motifs to steer the discovery of optoelectronic materials. Here, we develop an octahedral motif-centric, data-driven framework that couples interpretable machine learning with high-throughput first-principles calculations to accelerate the discovery of optoelectronic semiconductors. We construct motif-based descriptors to train a gradient boosting regression tree model for thermodynamic stability evaluation, achieving a low mean absolute error of 83 meV per atom on datasets comprising ~10

Identifiers

PMID42401581
PMCPMC13469113

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Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.