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670 积分 2024-10-23 加入
Langevin dynamics in constant pressure extended systems
1小时前
已完结
Structure, bonding, and adhesion at the TiC(100)/Fe(110) interface from first principles
1天前
已完结
Near-edge band structures and band gaps of Cu-based semiconductors predicted by the modified Becke-Johnson potential plus an on-site Coulomb U
20天前
已完结
Photoelectron spectrum and structure of B2O2
24天前
已完结
DFT calculations on the electronic structure of CuTe2 and Cu7Te4 Author links open overlay panel
26天前
已完结
Illumination-assisted annealing enables selenium solar cells with open-circuit voltage over 1 V and efficiency exceeding 10%
26天前
已完结
First-principles of wurtzite ZnO (0001) and (0001) surface structures
1个月前
已完结
Enhancing the energy density of CNO compounds through distorted carbon tetrahedra
1个月前
已完结
First Principles Determination of the Effects of Phosphorus and Boron on Iron Grain Boundary Cohesion
1个月前
已完结
New approaches for calculating absolute surface energies of wurtzite (0001)/(0001): A study of ZnO and GaN
1个月前
已完结
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