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594 积分 2025-08-31 加入
Iterative learning scheme for crystal structure prediction with anharmonic lattice dynamics
1小时前
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Observation of Altermagnetic Order Switching in Bulk MnTe by Polarized Neutron Diffraction
1天前
待确认
Chemical synthesis and materials discovery
3天前
已完结
Accurate prediction of dielectric properties and bandgaps in materials with a machine learning approach
3天前
已完结
Minimization of Atomic Displacements as a Guiding Principle of the Martensitic Phase Transformation
4天前
已完结
Nucleating a Different Coordination in a Crystal under Pressure: A Study of the B1−B2 Transition in NaCl by Metadynamics
11天前
已完结
Prediction of High-Temperature Superconductivity in Cubic Ternary Hydride M3XH8 at Ambient Pressure
11天前
已关闭
Bridging three-dimensional molecular structures and artificial intelligence with a conformation description language
15天前
已完结
The role of fluctuations in the nucleation process
16天前
已完结
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