Volumes and areas calculated from the idealized framework model
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Occupiable Volume | 162.11 | Å3 | (6.60 | %) | |||||
Accessible Volume | 160.95 | Å3 | (6.55 | %) | |||||
Occupiable Area | 222.46 | Å2 | (464.52 | m2/g) | |||||
Accessible Area | 213.24 | Å2 | (445.27 | m2/g) | |||||
Specific Occupiable Area | 905.11 | m2/cm3 | |||||||
Specific Accessible Area | 867.6 | m2/cm3 | |||||||
Maximum diameter of a sphere: | |||||||||
that can be included | 6.28 | Å | |||||||
that can diffuse along | a: 1.99 | Å | b: 5.48 | Å | c: 1.82 | Å |
Explanations | |||||
Occupiable volume | That portion of the available volume within the cell that can be visited by the center of a (spherical) water molecule (radius = 1.4Å). The available volume is the unit cell volume remaining after the van der Waals atomic sphere volumes are subtracted. | ||||
Occupiable area | The area of that surface visited by the center of the water molecule. | ||||
Accessible volume | That portion of the occupiable volume that has continuity between all unit unit cells. Some pores/cavities have windows that are too small to allow the water molecule access, and so represent isolated occupiable regions. | ||||
Accessible area | The area of that surface visited by the center of the water molecule. | ||||
Specific occupiable area | Occupiable area per unit volume | ||||
Specific accessible area | Accessible area per unit volume |
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