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150 积分 2024-02-01 加入
Extending machine learning beyond interatomic potentials for predicting molecular properties
1天前
待确认
Recent advances and outstanding challenges for machine learning interatomic potentials
1天前
已完结
Neural network potentials
7天前
已完结
Medium-range ordering, structural heterogeneity, and their influence on properties of Zr-Cu-Co-Al metallic glasses
1个月前
已完结
The new sight to Fe–C system
1个月前
已完结
Amorphous alloys for electrocatalysis: The significant role of the amorphous alloy structure
1个月前
已完结
Isomerization of surface functionalized SWCNTs and the critical influence on photoluminescence: static calculations and excited-state dynamics simulations
2个月前
已完结
Recent Progress in Research of Metal Melt Structure
3个月前
已完结
Short-Range Order Formed in an Equiatomic CoNiCrFeMn Alloy during Annealing. Atomistic MD/MC Simulation
4个月前
已完结
Optimization of the process parameters for the AlN crystal growth in the PVT method through an improved numerical simulation considering partial pressure of gas phases
4个月前
已完结
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