Adsorption of HCl on Single-Crystal α-Al2O3(0001) Surface:  A DFT Study

2003 ◽  
Vol 107 (1) ◽  
pp. 186-195 ◽  
Author(s):  
Saman Alavi ◽  
Dan C. Sorescu ◽  
Donald L. Thompson
Keyword(s):  
Single Crystal ◽  
Dft Study ◽  
Α Al2o3

Hybridization-reactivity relationship in Pb(II) adsorption on α-Al2O3-water interfaces: A DFT Study

2011 ◽  
Vol 115 (10) ◽  
pp. 4008-4021 ◽  
Author(s):  
Sara E. Mason ◽  
Thomas P. Trainor ◽  
Anne M. Chaka
Keyword(s):  
Dft Study ◽  
Α Al2o3

Growth mechanism of single-crystal α-Al2O3 nanofibers fabricated by electrospinning techniques

2011 ◽  
Vol 31 (5) ◽  
pp. 723-731 ◽  
Author(s):  
Pei-Ching Yu ◽  
Rung-Je Yang ◽  
Yi-Yang Tsai ◽  
Wolfgang Sigmund ◽  
Fu-Su Yen
Keyword(s):  
Single Crystal ◽  
Growth Mechanism ◽  
Α Al2o3

On hydrogen bonding in 2-amino-3-hydroxymethyl-1,3-propane diol (TRIS) – variable temperature neutron single crystal and DFT study

2007 ◽  
Vol 222 (10) ◽  
Author(s):  
L'ubomír Smrčok ◽  
Paula M. Briggs Piccoli ◽  
A. J. Schultz ◽  
Mariana Sládkovičová ◽  
Pavel Mach
Keyword(s):  
Hydrogen Bonding ◽  
Single Crystal ◽  
Variable Temperature ◽  
Dft Study

Effects of an α-Al2O3 thin film on the oxidation behavior of a single-crystal Ni-based superalloy

2004 ◽  
Vol 35 (3) ◽  
pp. 1055-1065 ◽  
Author(s):  
Y. -F. Su ◽  
W. Y. Lee ◽  
L. F. Allard ◽  
D. W. Coffey
Keyword(s):  
Thin Film ◽  
Single Crystal ◽  
Oxidation Behavior ◽  
Α Al2o3 ◽  
Al2o3 Thin Film

DFT study on the structure of Ni/α-Al2O3 catalysts

2013 ◽  
Vol 287 ◽  
pp. 97-107 ◽  
Author(s):  
Minhua Zhang ◽  
Jianyue Chen ◽  
Yingzhe Yu ◽  
Yongbo Zhang
Keyword(s):  
Dft Study ◽  
Α Al2o3

Desorption of H2O from a hydroxylated single-crystal α-Al2O3(0001) surface

1998 ◽  
Vol 416 (3) ◽  
pp. 341-353 ◽  
Author(s):  
C.E. Nelson ◽  
J.W. Elam ◽  
M.A. Cameron ◽  
M.A. Tolbert ◽  
S.M. George
Keyword(s):  
Single Crystal ◽  
Α Al2o3

Study of NbSi composites reinforced by single-crystal fibers of α-Al2O3 with and without interfacial coating

2016 ◽  
Vol 7 (1) ◽  
pp. 143-148 ◽  
Author(s):  
B. V. Shchetanov ◽  
I. U. Yefimochkin ◽  
V. V. Murashyova ◽  
T. M. Shcheglova
Keyword(s):  
Single Crystal ◽  
Crystal Fibers ◽  
Α Al2o3
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