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50 积分 2024-11-01 加入
PWmat MLFF: Generating Machine Learning Force Field in Plane-Wave Basis for Molecular Dynamics Simulation
2小时前
求助中
Applications and Advances in Machine Learning Force Fields
1个月前
已完结
Charge Transfer Modulated Activity of Carbon‐Based Electrocatalysts
3个月前
已完结
Mechanistic Differences between the Ru(II) and Zn(II)-Catalyzed Cross-Coupling of Cyclopropenes with Diazo Compounds: A DFT Study†
9个月前
已完结
Enhanced Base‐Free Formic Acid Production from CO2 on Pd/g‐C3N4 by Tuning of the Carrier Defects
10个月前
已完结
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