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140 积分 2025-07-18 加入
Au core stabilizes CO adsorption onto Pd leading to CO2 production
1个月前
已完结
Hydrogen adsorption in the presence of coadsorbed CO on Pd(111)
1个月前
已关闭
Theoretical Study of Weakly Bound Adsorbates on Au(111): Tests on van der Waals Density Functionals
1个月前
已完结
Stabilities and Reconstructions of PbTe Crystal Surfaces from Density-Functional Theory
1个月前
已完结
https://pubs.acs.org/doi/10.1021/acscatal.9b05371
2个月前
已完结
CO Adsorption and Activation of η-Fe2C Fischer–Tropsch Catalyst
2个月前
已完结
The application of DFT calculation in the study of iron-based catalyst for Fischer-Tropsch synthesis
3个月前
已完结
https://pubs.acs.org/doi/10.1021/acs.chemrev.2c00508
3个月前
已完结
Multiconfiguration Pair-Density Functional Theory with Quantum Embedding Predicts Correct CO Adsorption Sites on Copper Facets
4个月前
已完结
Molecular Dynamics Simulations of the Surface Reconstructions of Pt(557) and Au(557) under Exposure to CO
4个月前
已完结
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