Single-chiral-catalytic-surface-sites: STM and DFT study of stereodirecting complexes formed between (R)-1-(1-naphthyl)ethylamine and ketopantolactone on Pt(111)

2015 ◽  
Vol 5 (2) ◽  
pp. 743-753 ◽  
Author(s):  
Katrine Svane ◽  
Yi Dong ◽  
Michael N. Groves ◽  
Vincent Demers-Carpentier ◽  
Jean-Christian Lemay ◽  
...  
Keyword(s):  
Dft Study ◽  
Catalytic Surface ◽  
Surface Sites ◽  
Chiral Modifier

Revealing the set of most stable bimolecular complexes formed by a prochiral molecule and a chiral modifier on Pt(111).

scholarly journals DFT Study of Oxidation States on Pyrite Surface Sites

2015 ◽  
Vol 119 (14) ◽  
pp. 7704-7710 ◽  
Author(s):  
Tamás Rozgonyi ◽  
András Stirling
Keyword(s):  
Dft Study ◽  
Oxidation States ◽  
Pyrite Surface ◽  
Surface Sites

DFT study of the effect of hidrocarbonated chains on the electronic properties of some oligothiophene derivatives

2009 ◽  
Author(s):  
Manuel Fernández-Gómez ◽  
Amparo Navarro ◽  
MªPaz Fernández-Liencres ◽  
Mónica Moral ◽  
José Manuel Granadino-Roldán ◽  
...  
Keyword(s):  
Electronic Properties ◽  
Dft Study

Three-dimensional thermochemical nonequilibrium viscous flow over blunt bodies with catalytic surface

AIAA Journal ◽  
2001 ◽  
Vol 39 ◽  
pp. 626-636
Author(s):  
S. Peigin ◽  
V. Kazakov ◽  
M.-C. Druguet ◽  
S. Seror ◽  
D. E. Zeitoun
Keyword(s):  
Viscous Flow ◽  
Three Dimensional ◽  
Catalytic Surface ◽  
Blunt Bodies
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