2006 journal article

Adsorption of Simple Gases in MCM-41 Materials: The Role of Surface Roughness

LANGMUIR, 22(1), 194–202.

By: B. Coasne*, F. Hung*, R. Pellenq*, F. Siperstein* & K. Gubbins*

TL;DR: Comparison with adsorption and neutron scattering experiments suggests that model B is too rough at the molecular scale but reproduces reasonably the surface disorder of real MCM-41 at larger length scales, while model A is smooth at small length scales in agreement with experiments but seems to be too ordered at large length scales. (via Semantic Scholar)
UN Sustainable Development Goal Categories
Sources: Web Of Science, NC State University Libraries
Added: August 6, 2018

2005 journal article

Cosurfactant and cosolvent effects on surfactant self-assembly in supercritical carbon dioxide

JOURNAL OF CHEMICAL PHYSICS, 122(9).

By: N. Chennamsetty n, H. Bock n, L. Scanu n, F. Siperstein n & K. Gubbins n

TL;DR: The impact of alcohol additives on the self-assembly of surfactants in supercritical carbon dioxide is investigated using lattice Monte Carlo simulations, observing that all studied (model) alcohols reduce the critical micelle concentration and short-chain alcohols act as cosurfactants, directly influencing the properties of the aggregates. (via Semantic Scholar)
Sources: Web Of Science, NC State University Libraries
Added: August 6, 2018

2005 journal article

Molecular modeling of freezing of simple fluids confined within carbon nanotubes

JOURNAL OF CHEMICAL PHYSICS, 122(14).

By: F. Hung n, B. Coasne n, E. Santiso n, K. Gubbins n, F. Siperstein* & M. Sliwinska-Bartkowiak*

TL;DR: The simulations show evidence of a rich phase behavior in confinement; a number of phases, some of them inhomogeneous, were observed for the pore sizes considered and were found to be in good agreement with recent dielectric relaxation spectroscopy experiments for CCl(4) confined within multiwalled carbon nanotubes. (via Semantic Scholar)
UN Sustainable Development Goal Categories
13. Climate Action (Web of Science)
Sources: Web Of Science, NC State University Libraries
Added: August 6, 2018

2005 journal article

Molecular simulation of gas adsorption in realistic models of silica nanopores

ANNALES DE CHIMIE-SCIENCE DES MATERIAUX, 30(4), 375–383.

By: B. Coasne, F. Hung*, F. Siperstein* & K. Gubbins*

UN Sustainable Development Goal Categories
Sources: Web Of Science, NC State University Libraries
Added: August 6, 2018

2003 journal article

Phase separation and liquid crystal self-assembly in surfactant-inorganic-solvent systems

LANGMUIR, 19(6), 2049–2057.

By: F. Siperstein n & K. Gubbins n

UN Sustainable Development Goal Categories
Sources: Web Of Science, NC State University Libraries
Added: August 6, 2018

2002 chapter

Influence of synthesis conditions on surface heterogeneity of M41 type materials studied with lattice Monte Carlo

In Characterization of Porous Solids VI, Proceedings of the 6th International Symposium on the Characterization of Porous Solids (COPS-VI) (pp. 647–654).

By: F. Siperstein n & K. Gubbins n

Sources: NC State University Libraries, Crossref, NC State University Libraries
Added: August 6, 2018

Citation Index includes data from a number of different sources. If you have questions about the sources of data in the Citation Index or need a set of data which is free to re-distribute, please contact us.

Certain data included herein are derived from the Web of Science© and InCites© (2024) of Clarivate Analytics. All rights reserved. You may not copy or re-distribute this material in whole or in part without the prior written consent of Clarivate Analytics.