Molecular simulation of carbon dioxide/methane/hydrogen mixture adsorption in metal-organic frameworks.
about
Metal-organic frameworks for upgrading biogas via CO2 adsorption to biogas green energy.Diffusion of molecules in the bulk of a low density amorphous ice from molecular dynamics simulations.Transferable Force Field for Metal-Organic Frameworks from First-Principles: BTW-FF.Screening metal-organic frameworks for selective noble gas adsorption in air: effect of pore size and framework topology.Effect of chemical structure of S-nitrosothiols on nitric oxide release mediated by the copper sites of a metal organic framework based environment.Ligand and Metal Effects on the Stability and Adsorption Properties of an Isoreticular Series of MOFs Based on T-Shaped Ligands and Paddle-Wheel Secondary Building Units.Mapping of functional groups in metal-organic frameworks.A computational study of the effect of the metal organic framework environment on the release of chemically stored nitric oxide.A mesoporous cationic thorium-organic framework that rapidly traps anionic persistent organic pollutants.High-Throughput Computational Screening of the Metal Organic Framework Database for CH4/H2 Separations.The mechanism of an asymmetric ring-opening reaction of epoxide with amine catalyzed by a metal-organic framework: insights from combined quantum mechanics and molecular mechanics calculations.Two microporous Fe-based MOFs with multiple active sites for selective gas adsorption.Flexibility and swing effect on the adsorption of energy-related gases on ZIF-8: combined experimental and simulation study.Van der Waals forces in the perfluorinated metal-organic framework zinc 1,2-bis(4-pyridyl)ethane tetrafluoroterephthalate.Molecularly Tuned Free Volume of Vapor Cross-Linked 6FDA-Durene/ZIF-71 MMMs for H2 /CO2 Separation at 150 °C.Two microporous MOFs constructed from different metal cluster SBUs for selective gas adsorption.In silico screening of metal-organic frameworks in separation applications.Gas storage and separation in a water-stable [Cu(I)5BTT3](4-) anion framework comprising a giant multi-prismatic nanoscale cage.Calix[4]arene-based metal-organic frameworks: towards hierarchically porous materials.Experimental and theoretical investigations on the MMOF selectivity for CO2 vs. N2 in flue gas mixtures.Carbon dioxide adsorption by physisorption and chemisorption interactions in piperazine-grafted Ni2(dobdc) (dobdc = 1,4-dioxido-2,5-benzenedicarboxylate)Micro- and mesoporous CuBTCs for CO2/CH4 separationAdsorption and Separation of Light Gases on an Amino-Functionalized Metal-Organic Framework: An Adsorption and In Situ XRD StudyHigh-Pressure Hydrogen Adsorption in the Zeolites: A Grand Canonical Monte Carlo StudyPreparation of piperazine-grafted amine-functionalized UiO-66 metal organic framework and its application for CO2 over CH4 separation
P2860
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P2860
Molecular simulation of carbon dioxide/methane/hydrogen mixture adsorption in metal-organic frameworks.
description
2006 nî lūn-bûn
@nan
2006年の論文
@ja
2006年学术文章
@wuu
2006年学术文章
@zh
2006年学术文章
@zh-cn
2006年学术文章
@zh-hans
2006年学术文章
@zh-my
2006年学术文章
@zh-sg
2006年學術文章
@yue
2006年學術文章
@zh-hant
name
Molecular simulation of carbon ...... n in metal-organic frameworks.
@en
Molecular simulation of carbon ...... n in metal-organic frameworks.
@nl
type
label
Molecular simulation of carbon ...... n in metal-organic frameworks.
@en
Molecular simulation of carbon ...... n in metal-organic frameworks.
@nl
prefLabel
Molecular simulation of carbon ...... n in metal-organic frameworks.
@en
Molecular simulation of carbon ...... n in metal-organic frameworks.
@nl
P356
P1476
Molecular simulation of carbon ...... n in metal-organic frameworks.
@en
P2093
Chongli Zhong
Qingyuan Yang
P304
17776-17783
P356
10.1021/JP062723W
P407
P577
2006-09-01T00:00:00Z