2022
DOI: 10.1039/d2cp02520e
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Pore size effects on surface charges and interfacial electrostatics of mesoporous silicas

Abstract: Water in confinement becomes more structured than bulk water, and its properties, such as the dielectric constant, change. It remains unclear, however, how the interfacial reactions in confinement, such as...

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Cited by 13 publications
(18 citation statements)
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“…Considering that very small electrode pores are being under consideration and the electric dipole is not considered in the calculations of Figure 3 b,c, the relative dielectric constant in the pore is set as and in the bulk it is still set as . The molecular dynamics simulations show that the perpendicular component of the water dielectric constant drastically decreases in narrow pores [ 82 , 83 ] compared with the bulk water dielectric constant; so, we choose a small value for the dielectric constant of water in the pore. From the information provided in Figure 3 , we can produce four analyses.…”
Section: Resultsmentioning
confidence: 99%
“…Considering that very small electrode pores are being under consideration and the electric dipole is not considered in the calculations of Figure 3 b,c, the relative dielectric constant in the pore is set as and in the bulk it is still set as . The molecular dynamics simulations show that the perpendicular component of the water dielectric constant drastically decreases in narrow pores [ 82 , 83 ] compared with the bulk water dielectric constant; so, we choose a small value for the dielectric constant of water in the pore. From the information provided in Figure 3 , we can produce four analyses.…”
Section: Resultsmentioning
confidence: 99%
“…Their pore sizes, specific surface areas, and surface hydroxyl group densities have been reported elsewhere, as listed in Table S1 in the ESI. † 24 Each mesoporous silica will be denoted by an acronym combining ''M'' or ''S'' (the first letters of MCM-41 or SBA-15) with the corresponding mesopore diameter shown in Table S1 (ESI †). As in a previous study, mesoporous silicas were pretreated with washing and drying.…”
Section: Adsorption Experimentsmentioning
confidence: 99%
“…As in a previous study, mesoporous silicas were pretreated with washing and drying. 24 Milli-Q s grade pure water and analytical-grade chemicals purchased from Wako Pure Chemical Industries were used to prepare the solutions for the adsorption experiments. Unless noted otherwise, all batch experiments were conducted in ambient atmosphere at room temperature (20-25 1C), and the containers were continuously agitated with a shaker.…”
Section: Adsorption Experimentsmentioning
confidence: 99%
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