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List of works by Juan C. Santos

A theoretical study on the reaction mechanism for the bergman cyclization from the perspective of the electron localization function and catastrophe theory

scientific article published on 01 April 2005

An Aromaticity Scale Based on the Topological Analysis of the Electron Localization Function Including σ and π Contributions

scientific article published on 01 January 2005

Borazine: to be or not to be aromatic

Chapter 5 Understanding and using the electron localization function

Dibenzyl Disulfide Adsorption on Cationic Exchanged Faujasites: A DFT Study.

scientific article published on 8 May 2019

Local reactivity index as descriptor of benzene adsorption in cluster models of exchanged zeolite-Y

Local reactivity index defined through the density of states describes the basicity of alkaline-exchanged zeolites

article by Juan C. Santos et al published 8 March 2002 in Journal of Chemical Physics

Scrutiny of the HSAB Principle in Some Representative Acid−Base Reactions

Structure and stability of the Si4Lin (n=1–7) binary clusters

The Bonding Nature of Some Simple Sigmatropic Transition States from the Topological Analysis of the Electron Localization Function

Theoretical study of the Si5−n(BH)n2− and Na(Si5−n(BH)n)− (n = 0–5) systems

article

Theoretical study on CDK2 inhibitors using a global softness obtained from the density of states.

scientific article published on 3 March 2007

Topological analysis of the electron localization function applied to the study of the [1,3] sigmatropic shift of fluorine in 3-fluorpropene

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