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Chemicals, plastics and rubber industries

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Water dynamics on the surface of MCM-41 via (super 2)H double quantum filtered NMR and relaxation measurements

Article Abstract:

The line shape analyses of (super 2)H double quantum filtered (DQF) nuclear magnetic resonance (NMR) and T1 measurements were used to investigate the dynamics of water adsorbed on MCM-41. It was found that there are three sites for water adsorption on MCM-41, namely a slow site, a fast site I, and a fast site II.

Author: Lian-Pin Hwang, Hwang, Dennis W., Sinha, Anil K., Chi-Yuan Cheng, Tsyr-Yan Yu
Publisher: American Chemical Society
Publication Name: Journal of Physical Chemistry B
Subject: Chemicals, plastics and rubber industries
ISSN: 1520-6106
Year: 2001
Nuclear magnetic resonance, Adsorption

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Computer simulation of water in asymmetric slit-like nanopores

Article Abstract:

The grand canonical Monte Carlo (GCMC) technique was employed to simulate the behavior of water confined in open asymmetric slit-like nanopores. The GCMC technique proved to be capable of explicitly simulating the liquid-vapor interface for water in the asymmetric assignment.

Author: Grunze, Michael, Pertsin, Alexander
Publisher: American Chemical Society
Publication Name: Journal of Physical Chemistry B
Subject: Chemicals, plastics and rubber industries
ISSN: 1520-6106
Year: 2004
Usage, Monte Carlo method, Monte Carlo methods

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Subjects list: Research, Water, Chemistry, Physical and theoretical, Physical chemistry, Chemical properties
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