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| Prediction of mechanical properties of biodegradable zinc alloys based on machine learning |
GUO Chuanping1,
SHI Chenchen1, LIU Peng1, GAO Dongfang2, ZHAO
Yangyang3, QIAO Yang1
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1 School of Mechanical Engineering, University of
Jinan, Jinan 250022, China
2 Institute of Medical Sciences, Second Hospital of
Shandong University, Jinan 250033, China
3 Trauma Orthopedics, Second Hospital of Shandong
University, Jinan 250031, China
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Cite this article:
GUO Chuanping, SHI Chenchen, LIU Peng, GAO Dongfang, ZHAO Yangyang, QIAO Yang. Prediction of mechanical properties of biodegradable zinc alloys based on machine learning. Acta Metall Sin, 0, (): 0-0.
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Abstract
Recent studies indicate that zinc alloys are
preferred in biodegradable metal materials owing to their unique biodegradability
and biocompatibility. However, their mechanical properties are relatively
insufficient; thus, it is crucial to design zinc alloys that meet the
mechanical performance implantation standards required for application in
biomedicine. The traditional alloy design method depends on experience and
trial and error for low efficiency and high cost. In recent years, the rapid
development of artificial intelligence has provided new tools and methods for
material science. Machine learning (ML), a subset of artificial intelligence,
offers new ideas for material design and prediction. This study obtained the
mechanical property data of the Zn Mg Mn alloy through experimental
investigation and literature review. A performance-oriented ML model was used
to predict the compressive yield strength (CYS) and hardness of the Zn Mg Mn
alloy, considering various element types and contents and different alloy
preparation processes. Furthermore, the influence of the element types and
contents on the microstructure and macroscopic mechanical properties of the
material was explored. This model used an existing dataset and compared it with
seven different ML algorithms to determine that the k-nearest neighbor algorithm
has the best predictive ability, exceeding 90%. To further validate the
accuracy of the model prediction, a random method was used to select data
beyond the dataset for comparative analysis with the model results.
Simultaneously, the Shapley Additive exPlanations was applied to quantitatively
examine the correlation between the two alloying elements, the preparation
process, the CYS, and the hardness in the Zn Mg Mn alloy. The Mg element was
determined to significantly impact the alloy’s CYS and hardness. Finally, the
influence of individual elements on the mechanical properties of the materials
was analyzed through microstructure characterization; the results showed that
the formation of new phases (Mg2Zn11 and MgZn13)
due to adding these elements significantly affected the mechanical properties.
Based on the research results, this study proposed a composition ratio range
for the Zn Mg Mn alloy to satisfy the mechanical performance standards required
for medical implant materials. When Mg is between 2.25% and 2.50% (mass
fraction, the same below) and Mn is between 2.50% and 3.50%, the CYS and
hardness of the alloy comply with the implant standards.
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Received: 27 September 2024
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