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The carbon dioxide was chosen since its solubility in bulk water is high, which helps to accelerate simulation. The essential features were retained as nitrogen or oxygen was chosen.
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We also carried out MD simulations with silica tubes and a CNT with varying cross sections to better match the parallel experiments. Although different infiltration and defiltration rates were observed, similar gas-phase effects and tube radius effects were revealed
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We also carried out MD simulations with silica tubes and a CNT with varying cross sections to better match the parallel experiments. Although different infiltration and defiltration rates were observed, similar gas-phase effects and tube radius effects were revealed.
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The interaction between the CNT atoms and water molecules is the van der Waals interaction, whose cutoff distance is about 1 nm. The effect of the CNT capped end on initial infiltration behavior is secondary as long as the tube (pore) length is much longer than 1 nm.
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The interaction between the CNT atoms and water molecules is the van der Waals interaction, whose cutoff distance is about 1 nm. The effect of the CNT capped end on initial infiltration behavior is secondary as long as the tube (pore) length is much longer than 1 nm.
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The value can be estimated by adding the size of gas and liquid molecules, and the van der Waals equilibrium distances between the gas/liquid and liquid/solid molecules
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The value can be estimated by adding the size of gas and liquid molecules, and the van der Waals equilibrium distances between the gas/liquid and liquid/solid molecules.
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38
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33847661154
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The gas absorption analysis was performed at Quantachrome Instruments, Boynton Beach, FL
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The gas absorption analysis was performed at Quantachrome Instruments, Boynton Beach, FL.
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The aforementioned behaviors were observed in all nanoporous systems that we have tested with distinct average pore sizes. In the present study, although pore surface features and coatings of C8 and C18 silicas are somewhat different, they should not lead to the observed fundamental difference in the sorption isotherm curves
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18 silicas are somewhat different, they should not lead to the observed fundamental difference in the sorption isotherm curves.
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