Information-theoretical analysis for the SN2 exchange reaction CH3Cl + F−

Concurrent phenomena at the transition region of selected elementary chemical reactions: An information-theoretical complexity analysis

(2012) Rodolfo O. Esquivel et al.   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Information-theoretical complexity for the hydrogenic identity S N 2 exchange reaction

(2012) Moyocoyani Molina-Espíritu et al.   JOURNAL OF MATHEMATICAL CHEMISTRY

A quantum uncertainty relation based on Fisher's information

(2011) P Sánchez-Moreno et al.   Journal of Physics A-Mathematical and Theoretical

Information-theoretical complexity for the hydrogenic abstraction reaction

(2011) Rodolfo O. Esquivel et al.   MOLECULAR PHYSICS

A generalized statistical complexity measure: Applications to quantum systems

(2010) R. López-Ruiz et al.   JOURNAL OF MATHEMATICAL PHYSICS

Phenomenological Description of a Three-Center Insertion Reaction: An Information-Theoretic Study

(2010) Rodolfo O. Esquivel et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Information carriers and (reading them through) information theory in quantum chemistry

(2010) Paul Geerlings et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Fisher Information Study in Position and Momentum Spaces for Elementary Chemical Reactions

(2009) Sheila López-Rosa et al.   Journal of Chemical Theory and Computation

Fisher information and kinetic energy functionals: A dequantization approach

(2009) I.P. Hamilton et al.   JOURNAL OF COMPUTATIONAL AND APPLIED MATHEMATICS

Phenomenological description of selected elementary chemical reaction mechanisms: An information-theoretic study

(2009) R.O. Esquivel et al.   PHYSICS LETTERS A

Phenomenological description of the transition state, and the bond breaking and bond forming processes of selected elementary chemical reactions: an information-theoretic study

(2009) Rodolfo O. Esquivel et al.   THEORETICAL CHEMISTRY ACCOUNTS

Analysis of diatomic bond dissociation and formation in terms of the reaction force and the position-dependent reaction force constant

(2008) Jane S. Murray et al.   JOURNAL OF MOLECULAR MODELING

The reaction force and the transition region of a reaction

(2008) Alejandro Toro-Labbé et al.   JOURNAL OF MOLECULAR MODELING

Theoretical Study of the Regioselectivity of [2 + 2] Photocycloaddition Reactions of Acrolein with Olefins

(2008) Pablo Jaque et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Analyzing Kullback–Leibler information profiles: an indication of their chemical relevance

(2008) Alex Borgoo et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS