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40 积分 2023-05-15 加入
Adsorption on Ordered and Disordered Duplex Layers of Porous Anodic Alumina
4个月前
已完结
Effect of the damping function in dispersion corrected density functional theory
5个月前
已完结
A consistent and accurateab initioparametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
5个月前
已完结
From ultrasoft pseudopotentials to the projector augmented-wave method
5个月前
已完结
Projector augmented-wave method
5个月前
已完结
Ab Initio Study of the H2–H2S/MoS2 Gas–Solid Interface: The Nature of the Catalytically Active Sites
5个月前
已完结
Self-Consistent Equations Including Exchange and Correlation Effects
5个月前
已完结
Generalized Gradient Approximation Made Simple
5个月前
已完结
Unraveling the Structure–Reactivity Relationship of CuFe2O4 Oxygen Carriers for Chemical Looping Combustion: A DFT Study
5个月前
已完结
Generalized Gradient Approximation Made Simple
6个月前
已完结
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