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Constructing Accurate and Efficient General-Purpose Atomistic Machine Learning Model with Transferable Accuracy for Quantum Chemistry
16小时前
已完结
High entropy alloys in electrocatalytic conversion and hydrogen energy storage: Machine learning-assisted prediction of intermediate reaction descriptors- A comprehensive review
1天前
求助中
A first-principles study of hydrogen storage of high entropy alloy TiZrVMoNb
1天前
已完结
Formation of Zr-rich BCC phase and its relation on the hydrogen storage properties of TiVNbZr high entropy alloy
1天前
已完结
Machine learning-based prediction of high-entropy alloys for hydrogen storage with optimized thermodynamic and kinetic parameters
2天前
已完结
Tailoring the mechanical properties and strengthening mechanisms of CoCrFeNi high-entropy alloy through minor elemental alloying: A comprehensive review
2天前
求助中
Machine learning to explore high-entropy alloys with desired enthalpy for room-temperature hydrogen storage: Prediction of density functional theory and experimental data
2天前
已完结
General Framework for Geometric Deep Learning on Tensorial Properties of Molecules and Crystals
4天前
已完结
Extending machine learning beyond interatomic potentials for predicting molecular properties
4天前
已完结
Mechanical properties of 2D materials: A review on molecular dynamics based nanoindentation simulations
14天前
已完结
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