Lv5
1560 积分 2024-11-03 加入
High-Throughput Computational Exploration of MOFs with Open Cu Sites for Adsorptive Separation of Hydrogen Isotopes
21天前
已完结
Predicting Methane Storage in Open-Metal-Site Metal–Organic Frameworks
21天前
已完结
Modeling adsorption in metal-organic frameworks with open metal sites: propane/propylene separations
21天前
已完结
Understanding hydrogen adsorption in metal-organic frameworks with open metal sites: a computational study
21天前
已完结
Quantum sieving of H 2 /D 2 in MOFs: a study on the correlation between the separation performance, pore size and temperature
22天前
已完结
Accurate and Compatible Force Fields for Molecular Oxygen, Nitrogen, and Hydrogen to Simulate Gases, Electrolytes, and Heterogeneous Interfaces
23天前
已完结
Revisting Lennard Jones, Morse, and N-M potentials for metals
23天前
已完结
Transferable Force Field for Metal–Organic Frameworks from First-Principles: BTW-FF
23天前
已完结
Development and Validation of ReaxFF Reactive Force Field for Hydrocarbon Chemistry Catalyzed by Nickel
23天前
已完结
Transition metal-catalyzed C-C/C-N bond formation
23天前
已完结
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