List of works - Luiz F A Ferrão

A multireference configuration interaction study of CuB and CuAl molecular constants and photoionization spectra

scientific article published on 01 September 2013

A product branching ratio controlled by vibrational adiabaticity and variational effects: Kinetics of the H + trans-N2H2 reactions

scientific article published in May 2012

A quantitative tool to establish magic number clusters, ε3, applied in small silicon clusters, Si2-11

scientific article published on 13 July 2018

Comparative study of small boron, silicon and germanium clusters: B(m)Si(n) and B(m)Ge(n) (m + n = 2-4).

scientific article published on 13 May 2015

Dehydrogenation of N2HX (X=2-4) by nitrogen atoms: thermochemical and kinetics.

scientific article

How to efficiently tune the biradicaloid nature of acenes by chemical doping with boron and nitrogen.

scientific article published on 12 July 2017

Hydrogen abstraction from the hydrazine molecule by an oxygen atom.

scientific article published on 23 September 2014

Identification of Magic Numbers in Homonuclear Clusters: The ε3 Stability Ranking Function

scientific article published on 31 December 2019

Multireference study of ionic/covalent electronic states of MF (M = Be, Mg and Ca)

scientific article published on 02 March 2020

On the importance of non-covalent interactions for porous membranes: unraveling the role of pore size

scientific article published on 01 August 2018

Singlet La and Lb Bands for N-Acenes (N = 2-7): A CASSCF/CASPT2 Study

scientific article published on 18 July 2017

Stability and Reactivity of Silicon Magic Numbers Doped with Aluminum and Phosphorus Atoms

scientific article published on 18 December 2018

Theoretical and experimental study for the biomimetic recognition of levothyroxine hormone on magnetic molecularly imprinted polymer

scientific article published on 31 January 2018

Thermochemical and Kinetics of CH3SH + H Reactions: The Sensitivity of Coupling the Low and High-Level Methodologies.

scientific article published on 22 December 2016

Thermochemical and Kinetics of Hydrazine Dehydrogenation by an Oxygen Atom in Hydrazine-Rich Systems: A Dimer Model

scientific article published on 23 November 2015

Thermochemical and kinetics studies of the CH3SH+S (3P) hydrogen abstraction and insertion reactions.

scientific article published on 10 September 2014

List of works by Luiz F A Ferrão