Models

NLDFT equilibrium adsorption models available in the standard version.

New models added (2019-2020).

Carbons 

  • Carbon-N2-77, 2D-NLDFT Heterogeneous Surface [4-5]
  • Carbon-Ar-87, 2D-NLDFT Heterogeneous Surface [12]
  • Carbon-O2-77, 2D-NLDFT Heterogeneous Surface [12]
  • Carbon-H2-77, 2D-NLDFT Heterogeneous Surface [14]
  • Carbon-N2-77, 2D-NLDFT Cylindrical Het Surface (ZTC) [15]
  • Carbon-CO2-273, 2D-NLDFT Het Surface, pmax=10 atm [6]
  • Carbon-N2-77, NLDFT Standard Slit
  • Carbon-Ar-87, NLDFT Standard Slit
  • Carbon-CO2-273, NLDFT Standard Slit, pmax=10 atm

Oxides 

  • Oxide-Ar-87, 2D-NLDFT Heterogeneous Surface (MCM-41) [9]
  • Oxide-Ar-87, Desorption, 2D-NLDFT Het Surface (MCM-41)  [9]

Metal Organic Frameworks (MOFs)

  • MOF-Ar-87, Cylindrical Mesopores, 2D-NLDFT Het Surface [10]

Carbon Nanotubes 

  • Carbon-N2-77, NLDFT, Cylindrical model, MWNT
  • Carbon-Ar-87, NLDFT, Cylindrical model, MWNT

Finite Pore Models 

  • Carbon-N2-77, 2D-NLDFT, Finite pores, Aspect ratio 6 [7]
  • Carbon-Ar-87, 2D-NLDFT, Finite pores, Aspect ratio 6

Zeolites   Cylindrical models:

  • Zeolites (H-Form)-Ar-87, NLDFT
  • Zeolites (Me-Form)-Ar-87, NLDFT
  • Zeolites (H-Form)-Ar-77, NLDFT
  • Zeolites (Me-Form)-Ar-77, NLDFT
  • Zeolites (H-Form)-N2-77, NLDFT
  • Zeolites (Me-Form)-N2-77, NLDFT

Development of new models for new materials is in progress.