A new determination of group-modified pore size distribution of activated carbon from confined density distribution

Y Yao Qin L Ling Zhu Y Yulin Liu Y Yudan Zhu (College of Chemical Engineering, State Key Laboratory of Materials-oriented Chemical Engineering, Nanjing Tech University 1 , Nanjing 211816,) X Xiaohua Lu (College of Chemical Engineering, State Key Laboratory of Materials-oriented Chemical Engineering, Nanjing Tech University 1 , Nanjing 211816,)

Abstract

The two-distribution model is developed to determine the group-modified pore size distribution (PSD) of activated carbon, where the PSD is modified by the group distribution. This model assumes an ensemble composed of the elementary confined density distribution for fluids and the group-modified PSD for activated carbon. The group-modified PSD is derived by fitting the theoretical adsorption, calculated using the two-distribution model with grand canonical Monte Carlo simulation-dependent kernels of the N2 isotherm at 77.4 K and a single CO2 adsorption data point at 273.0 K, to experimental adsorption data for activated carbon. The group-modified PSD is validated against adsorption data for seven fluids on various activated carbons. In this analysis, the adsorption isotherms calculated using the two-distribution model with PSD, homogeneous group-modified PSD, and inhomogeneous group-modified PSD are compared and evaluated. The results show that the two-distribution model accurately interprets the group-modified PSD.

Article Details

Volume / Issue Vol. 162, Issue 9
Published March 07, 2025
ISSN 0021-9606
Publisher American Institute of Physics

Journal Info

The Journal of Chemical Physics

American Institute of Physics

ISSN: 0021-9606 Physical Sciences

Authors (5)

Y

Yao Qin

L

Ling Zhu

Y

Yulin Liu

Y

Yudan Zhu

College of Chemical Engineering, State Key Laboratory of Materials-oriented Chemical Engineering, Nanjing Tech University 1 , Nanjing 211816,

X

Xiaohua Lu

College of Chemical Engineering, State Key Laboratory of Materials-oriented Chemical Engineering, Nanjing Tech University 1 , Nanjing 211816,