Hydrolysis of the amorphous silica surface. I. Structure and dynamics of the dry surface

2000 ◽  
Vol 113 (20) ◽  
pp. 9180-9190 ◽  
Author(s):  
Mark Wilson ◽  
Tiffany R. Walsh
Keyword(s):  
Amorphous Silica ◽  
Silica Surface ◽  
Structure And Dynamics ◽  
Hydrolysis Of

Hydrolysis of the amorphous silica surface. II. Calculation of activation barriers and mechanisms

2000 ◽  
Vol 113 (20) ◽  
pp. 9191-9201 ◽  
Author(s):  
Tiffany R. Walsh ◽  
Mark Wilson ◽  
Adrian P. Sutton
Keyword(s):  
Amorphous Silica ◽  
Silica Surface ◽  
Activation Barriers ◽  
Hydrolysis Of

Hydrolysis of a two-membered silica ring on the amorphous silica surface

2004 ◽  
Vol 120 (2) ◽  
pp. 1044-1054 ◽  
Author(s):  
Mao-Hua Du ◽  
Andrew Kolchin ◽  
Hai-Ping Cheng
Keyword(s):  
Amorphous Silica ◽  
Silica Surface ◽  
Hydrolysis Of

The Dissociated Amorphous Silica Surface: Model Development and Evaluation

2010 ◽  
Vol 6 (11) ◽  
pp. 3456-3471 ◽  
Author(s):  
Ali A. Hassanali ◽  
Hui Zhang ◽  
Chris Knight ◽  
Yun Kyung Shin ◽  
Sherwin J. Singer
Keyword(s):  
Amorphous Silica ◽  
Silica Surface ◽  
Model Development ◽  
Surface Model

Grafting Strategy to Develop Single Site Titanium on an Amorphous Silica Surface

Langmuir ◽  
2009 ◽  
Vol 25 (12) ◽  
pp. 7148-7155 ◽  
Author(s):  
M. C. Capel-Sanchez ◽  
G. Blanco-Brieva ◽  
J. M. Campos-Martin ◽  
M. P. de Frutos ◽  
W. Wen ◽  
...  
Keyword(s):  
Amorphous Silica ◽  
Silica Surface ◽  
Single Site

scholarly journals Hydroxylated crystalline edingtonite silica faces as models for the amorphous silica surface

2008 ◽  
Vol 117 ◽  
pp. 012026 ◽  
Author(s):  
S Tosoni ◽  
B Civalleri ◽  
F Pascale ◽  
P Ugliengo
Keyword(s):  
Amorphous Silica ◽  
Silica Surface

Models for biomedical interfaces: a computational study of quinone-functionalized amorphous silica surface features

2017 ◽  
Vol 19 (11) ◽  
pp. 7793-7806 ◽  
Author(s):  
Marta Corno ◽  
Massimo Delle Piane ◽  
Patrick Choquet ◽  
Piero Ugliengo
Keyword(s):  
Amorphous Silica ◽  
Silica Surface ◽  
Computational Study ◽  
Antimicrobial Properties ◽  
Surface Features ◽  
Silica Surfaces

The structural and IR features of amorphous silica surfaces, functionalized by ortho-benzoquinone groups, were computed to obtain a deeper knowledge of multifunctional coatings with antimicrobial properties.

DFT Investigation into Alumina ALD Growth Inhibition on Hydroxylated Amorphous Silica Surface

2015 ◽  
Vol 119 (32) ◽  
pp. 18380-18388 ◽  
Author(s):  
Aditya Shankar Sandupatla ◽  
Konstantinos Alexopoulos ◽  
Marie-Françoise Reyniers ◽  
Guy B. Marin
Keyword(s):  
Growth Inhibition ◽  
Amorphous Silica ◽  
Silica Surface
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