화학공학소재연구정보센터
검색결과 : 4건
No. Article
1 Understanding chemical binding using the Berlin function and the reaction force
Chakraborty D, Cardenas C, Echegaray E, Toro-Labbe A, Ayers PW
Chemical Physics Letters, 539, 168, 2012
2 Insights into the Mechanism of an S(N)2 Reaction from the Reaction Force and the Reaction Electronic Flux
Giri S, Echegaray E, Ayers PW, Nunez AS, Lund F, Toro-Labbe A
Journal of Physical Chemistry A, 116(40), 10015, 2012
3 The mechanics of charge-shift bonds: A perspective from the electronic stress tensor
Jenkins S, Kirk SR, Guevara-Garcia A, Ayers PW, Echegaray E, Toro-Labbe A
Chemical Physics Letters, 510(1-3), 18, 2011
4 Reaction Electronic Flux: A New Concept To Get Insights into Reaction Mechanisms. Study of Model Symmetric Nucleophilic Substitutions
Echegaray E, Toro-Labbe A
Journal of Physical Chemistry A, 112(46), 11801, 2008