2022
DOI: 10.1063/5.0087381
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Image-based machine learning for materials science

Abstract: Materials research studies are dealing with a large number of images, which can now be facilitated via image-based machine learning techniques. In this article, we review recent progress of machine learning-driven image recognition and analysis for the materials and chemical domains. First, the image-based machine learning that facilitates the property prediction of chemicals or materials is discussed. Second, the analysis of nanoscale images including those from a scanning electron microscope and a transmissi… Show more

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Cited by 31 publications
(13 citation statements)
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“…Currently, data in materials science can be broadly classified into four types: experimental and simulated material properties (such as physical, chemical, structural, thermodynamic, and dynamic properties), [64] chemical reaction data (including reaction rates, reaction temperatures, etc. ), [65] image data (such as scanning electron microscope images of materials and photos of material surfaces), [66] and data from literature sources. These data can be discrete (e.g., texts), continuous (e.g., vectors and tensors), or in the form of weighted graphs.…”
Section: Data Selectionmentioning
confidence: 99%
“…Currently, data in materials science can be broadly classified into four types: experimental and simulated material properties (such as physical, chemical, structural, thermodynamic, and dynamic properties), [64] chemical reaction data (including reaction rates, reaction temperatures, etc. ), [65] image data (such as scanning electron microscope images of materials and photos of material surfaces), [66] and data from literature sources. These data can be discrete (e.g., texts), continuous (e.g., vectors and tensors), or in the form of weighted graphs.…”
Section: Data Selectionmentioning
confidence: 99%
“…They have shown particular success in medical imaging applications 4–6 especially in cancer research 7,8 for example in mitosis detection in breast cancer histology images. 9 The use of machine learning can currently be followed through all fields of sciences, for example biology through the use in biosensors, 10 in chemistry for drug discovery 11 and in the computer-aided synthesis planning, 12 in material science 13 and physics 14 for example in nano-photonics, 15 but also astronomy 16–18 and particle physics. 19…”
Section: Introductionmentioning
confidence: 99%
“…Machine learning and artificial intelligence are becoming invaluable methods that enable faster discovery, innovation, and automation in chemical and materials sciences and engineering. In particular, machine learning has found tremendous use in automating materials’ structural analysis, which is a vital step in establishing the design–structure–property relationship of a novel material. For example, structural characterization of materials often depends on microscopy imaging techniques (e.g., scanning electron microscopy (SEM), transmission electron microscopy (TEM), or atomic force microscopy (AFM)) to visualize nanoscale or microscale structural features or patterns . Deep learning models used for pattern recognition and image analysis have been adopted as a viable means to automatically extract structural information from microscopy images regarding the ordered arrangements of the molecules, types of ordered assembly, and detection of objects’ (e.g., nanoparticles, assembled domains) shapes and sizes. There are unique challenges, however, with training machine learning models that are used for everyday photographic image analysis to analyze materials’ microscopy images. For example, compared to photographic images of everyday objects that often are easily recognizable, materials’ microscopy images require detailed metadata of the material, chemistry, synthesis conditions, and imaging process conditions as labels.…”
Section: Introductionmentioning
confidence: 99%