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. 2022 Mar 11;9:74. doi: 10.1038/s41597-022-01181-0

Table 3.

Description of geometric features generated by Zeo++ with definitions and units.

variable name explanation units
Df maximum free sphere Å
Di maximum included sphere Å
Dif maximum included sphere in the free sphere path Å
GPOAV gravimetric pore accessible volume cm3/g
GPONAV gravimetric pore non-accessible volume cm3/g
GPOV gravimetric pore volume cm3/g
GSA gravimetric surface area m2/g
POAV pore accessible volume Å3
PONAV pore non-accessible volume Å3
POAVF pore accessible volume fraction unitless
PONAVF pore non-accessible volume fraction unitless
VPOV volumetric pore volume cm3/cm3
VSA volumetric surface area m2/cm3
ρ crystal density g/cm3