Molecular dynamics and solid–solid phase transformation kinetics studies of tert-butyl chloride confined in mesoporous silica by NQR

2005 ◽  
Vol 107-108 ◽  
pp. 741-749 ◽  
Author(s):  
Griselda A. Eimer ◽  
Julio D. Fernández ◽  
Aldo H. Brunetti
Keyword(s):  
Molecular Dynamics ◽  
Phase Transformation ◽  
Mesoporous Silica ◽  
Solid Phase ◽  
Transformation Kinetics ◽  
Butyl Chloride ◽  
Tert Butyl ◽  
Kinetics Studies ◽  
Solid Phase Transformation ◽  
Tert Butyl Chloride

scholarly journals Molecular Dynamics of Tert-butyl Chloride Confined to CPG (7.4, 15.6 nm)

2005 ◽  
Vol 108 (2) ◽  
pp. 357-370
Author(s):  
L. Szutkowska ◽  
B. Peplińska ◽  
S. Jurga
Keyword(s):  
Molecular Dynamics ◽  
Butyl Chloride ◽  
Tert Butyl ◽  
Tert Butyl Chloride

Molecular dynamics of tert-butyl chloride confined in CPG studied by NMR

2004 ◽  
Vol 25 (1-3) ◽  
pp. 177-184 ◽  
Author(s):  
Lidia Wasyluk ◽  
Barbara Peplińska ◽  
Stefan Jurga
Keyword(s):  
Molecular Dynamics ◽  
Butyl Chloride ◽  
Tert Butyl ◽  
Tert Butyl Chloride

scholarly journals A model for electrochemical insertion limited by a phase transition process - eilpt

2003 ◽  
Vol 39 (1-2) ◽  
pp. 353-368 ◽  
Author(s):  
N. Adhoum ◽  
J. Bouteillon ◽  
D. Dumas ◽  
J.C. Poignet
Keyword(s):  
Phase Transition ◽  
Phase Transformation ◽  
Solid Phase ◽  
Transition Process ◽  
Equilibrium Potential ◽  
Transformation Kinetics ◽  
Electrode Thickness ◽  
Cathodic Material ◽  
Phase Transition Process ◽  
Solid Phase Transformation

This paper deals with electrochemical insertion into a cathodic material. New results on modeling of the influence of a solid phase transformation on the shape of voltamograms are presented. The original experiments concern the insertion of sodium into carbon during the cathodic reduction of molten NaF at 1020 ?C, but in the present manuscript emphasis on the theoretical aspects of the work is put. Phase transformations during electrochemical insertion are taken into account, with various values for parameters such as the thermodynamic biphase equilibrium potential, the compared diffusion and phase transformation kinetics, and the electrode thickness. The voltamograms calculated present very specific features; some of them have already been observed experimentally in literature.

Sign in / Sign up

Export Citation Format

Share Document