Extreme gradient boosting machine for modeling hydrogen gas storage in carbon slit pores from molecular simulation data
To accelerate the computation of hydrogen storage capacity in uniform slit-shaped porous carbon determined by molecular simulation, the traditional Gradient Boosting and XGBoost algorithms are introduced to create the predictive models, and evaluate their prediction effectiveness and accuracy. The r...
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| Format: | Article |
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2023
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| Online Access: | https://repository.li.mahidol.ac.th/handle/123456789/87529 |
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| Institution: | Mahidol University |