Surendra Kumar Jain

Molecular-level simulations of chemical reaction equilibrium for nitric oxide dimerization reaction in disordered nanoporous carbons

FLUID PHASE EQUILIBRIA, 272(1-2), 18–31.

Adsorption and dynamics of argon in porous carbons

European Physical Journal. Special Topics, 141, 121–125.

Freezing of argon in ordered and disordered porous carbon

PHYSICAL REVIEW B, 76(8).

Ring connectivity: Measuring network connectivity in network covalent solids

LANGMUIR, 23(3), 1123–1130.

Adsorption and structure of argon in activated porous carbons

MOLECULAR SIMULATION, 32(7), 557–566.

Adsorption, structure and dynamics of fluids in ordered and disordered models of porous carbons

MOLECULAR PHYSICS, Vol. 104, pp. 3491–3499.

Freezing of fluids confined in a disordered nanoporous structure

Physical Review Letters, 97(10).

Molecular modeling of porous carbons using the hybrid reverse Monte Carlo method

LANGMUIR, 22(24), 9942–9948.

Stability of porous carbon structures obtained from reverse Monte Carlo using tight binding and bond order Hamiltonians

Characterization of porous solids vii - proceedings of the 7th international symposium on the characterization of porous solids (cops-vii), aix-en-provence, france, 26-28 may 2005, 160, 169–176.

Structure of saccharose-based carbon and transport of confined fluids: hybrid reverse Monte Carlo reconstruction and simulation studies

MOLECULAR SIMULATION, 32(7), 567–577.

Effects of activation on the structure and adsorption properties of a nanoporous carbon using molecular simulation

ADSORPTION-JOURNAL OF THE INTERNATIONAL ADSORPTION SOCIETY, Vol. 11, pp. 355–360.