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Chemicals, plastics and rubber industries

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Ab initio molecular dynamics study of a monomolecular water layer on octahedral and tetrahedral kaolinite surfaces

Article Abstract:

The structure and dynamics of a monomolecular water layer on the octahedral and tetrahedral surfaces of the kaolinite layer have been investigated using short-time ab initio molecular dynamics. It is shown that the octahedral and tetrahedral surfaces of the kaolinite layer are of different chemical nature and can be considered as hydrophilic and hydrophobic, respectively.

Author: Gerzabek, Martin H., Tunega, Daniel, Lischka, Hans
Publisher: American Chemical Society
Publication Name: Journal of Physical Chemistry B
Subject: Chemicals, plastics and rubber industries
ISSN: 1520-6106
Year: 2004
Science & research, Research, Surface chemistry, Stereochemistry, Kaolinite

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Evidence for the existence of ternery complexes of iron, cyclodextrin, and hydrophobic guests in aqueous solution

Article Abstract:

A study was conducted to analyze the formation of pollutant/carboxymethyl-beta-cyclodextrin (CMCD)/Fe(super 2+) ternery complex in aqueous solution. The result reveals that the enhanced degradation of pollutant with addition of CMCD is due to the closer location of degradation catalyst to the target molecules.

Author: Tarr, Matthew A., Zheng, Weixi
Publisher: American Chemical Society
Publication Name: Journal of Physical Chemistry B
Subject: Chemicals, plastics and rubber industries
ISSN: 1520-6106
Year: 2004
All Other Miscellaneous Chemical Product and Preparation Manufacturing, Catalysts, Chemical preparations, not elsewhere classified, Analysis, Pollutants, Chemical properties

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