Micromeritics ASAP 2460, Operator'S Manual

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ASAP 2460 Operator’s Manual Appendix F
246-42800-01 - Aug 2013 F-9
C02 - DFT Model
Model isotherms were calculated using the non-local prescription of Tarazona, employing molecular
parameters derived from the known bulk properties of carbon dioxide.
AR - Modified Density Functional Model
This model was produced in the same manner as the N2 Modified Density Functional model listed ear-
lier, except applicable to argon adsorbed at 87.3 K.
N2 - Tarazona NLDFT, Esf = 30.0K
References
: Mietec Jaroniec, Michal Kruk, James P. Olivier and Stefan Koch, “A
New Method for the Characterization of Mesoporous Silicas,”
Proceedings of COPS-V, 1999, Studies in Surface Science, Vol 128,
Characterization of porous Solids V , Unger, et al, Eds, Elsevier,
Amsterdam, 2000.
James P. Olivier and Mario L. Occelli, “Surface Area and Microporosity
of a Pillared Interlayered Clay (PILC) from a Hybrid Density Functional
Theory (DFT) Method,”
The Journal of Physical Chemistry B ; 2001,
105(3), 623-629.
M. L. Occelli, J. P. Olivier, J. A. Perdigon-Melon, and A. Auroux,
“Surface Area, Pore Volume Distribution, and Acidity in Mesoporous
Expanded Clay Catalysts from Hybrid Density Functional Theory (DFT)
and Adsorption Microcalorimetry Methods,”
Langmuir 2002, 18, 9816-
9823.9b.
James P. Olivier, “The Importance of Surface Heterogeneity in
Developing Characterization Methods.”
6
th
International Symposium on
the Characterization of Porous Solids , Studies in Surface Science and
Catalysis 144, Elsevier, 2002.
James P. Olivier and Mario L. Occelli, “Surface Area and Microporosity
of Pillared Rectorite Catalysts from a Hybrid Density Functional Theory
Method,”
Microporous and Mesoporous Materials 2003, 57, 291-296.
Geometry
Slit
Substrate
Carbon
Category:
Porosity
Method:
Carbon dioxide at 273 K
Geometry
Free Surface
Substrate
Any
Category:
Surface energy
Method:
Argon at 87 K
Geometry
Cylinder