A nomograph for the estimation of the activation energies of unimolecular reactions

1943 ◽  
Vol 20 (3) ◽  
pp. 134
Author(s):  
Earl Warrick
1983 ◽  
Vol 79 (6) ◽  
pp. 2763-2770 ◽  
Author(s):  
Joseph L. Katz ◽  
Joseph G. Ruggiero ◽  
Richard Partch ◽  
Dale Warren ◽  
F. H. Ebetino

2002 ◽  
Vol 719 ◽  
Author(s):  
Masashi Kato ◽  
Masaya Ichimura ◽  
Eisuke Arai ◽  
Shigehiro Nishino

AbstractEpitaxial layers of 4H-SiC are grown on (0001) substrates inclined toward <1120> and <1100> directions. Defects in these films are characterized by deep level transient spectroscopy (DLTS) in order to clarify the dependence of concentrations and activation energies on substrate inclination. DLTS results show no such dependence on substrate inclination but show thickness dependence of the concentration.


2015 ◽  
Vol 19 (1/2) ◽  
Author(s):  
L. I. Panasjuk ◽  
V. V. Kolomoets ◽  
V. N. Ermakov ◽  
S. A. Fedosov ◽  
L. V. Yashchynskiy

1989 ◽  
Vol 54 (5) ◽  
pp. 1311-1317
Author(s):  
Miroslav Magura ◽  
Ján Vojtko ◽  
Ján Ilavský

The kinetics of liquid-phase isothermal esterification of POCl3 with 2-isopropylphenol and 4-isopropylphenol have been studied within the temperature intervals of 110 to 130 and 90 to 110 °C, respectively. The rate constants and activation energies of the individual steps of this three-step reaction have been calculated from the values measured. The reaction rates of the two isomers markedly differ: at 110 °C 4-isopropylphenol reacts faster by the factors of about 7 and 20 for k1 and k3, respectively. This finding can be utilized in preparation of mixed triaryl phosphates, since the alkylation mixture after reaction of phenol with propene contains an excess of 2-isopropylphenol over 4-isopropylphenol.


Author(s):  
Kjell Jorner ◽  
Tore Brinck ◽  
Per-Ola Norrby ◽  
David Buttar

Hybrid reactivity models, combining mechanistic calculations and machine learning with descriptors, are used to predict barriers for nucleophilic aromatic substitution.


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