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Alexandre B Rocha

Showing results (11-20 of 18) with videos related to

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The Journal of Physical Chemistry. A|March 30, 2023
Revisiting the Spectrum of Co(CN)<sub>6</sub><sup>3-</sup>: The Role of Correlation, Solvation, and Vibronic and Spin-Orbit CouplingsAmanda D Torres, Marcos A S Francisco, Ricardo R Oliveira, et al.
Journal of Molecular Modeling|August 11, 2022
Comparison among several vibronic coupling methodsAmanda D Torres, Carlos E V de Moura, Ricardo R Oliveira, et al.
Physical Chemistry Chemical Physics : PCCP|September 19, 2023
Gas-phase C<sub>60</sub>H<sub></sub><sup>+</sup> (<i>n</i> = 0-4, <i>q</i> = 0,1) fullerenes and fulleranes: spectroscopic simulations shed light on cosmic molecular structuresRicardo R Oliveira, Germán Molpeceres, Ricardo Montserrat, et al.
The Journal of Physical Chemistry. B|March 17, 2011
Ab initio simulation of changes in geometry, electronic structure, and Gibbs free energy caused by dehydration of hydrotalcites containing Cl⁻ and CO₃²⁻ counteranionsDeyse G Costa, Alexandre B Rocha, Wladmir F Souza, et al.
The Journal of Physical Chemistry. A|June 15, 2010
Theoretical investigation on the stability of negatively charged formic acid clustersLeonardo Baptista, Diana P P Andrade, Alexandre B Rocha, et al.
The Journal of Physical Chemistry. B|August 11, 2006
Characterization by 27Al NMR, X-ray absorption spectroscopy, and density functional theory techniques of the species responsible for benzene hydrogenation in Y zeolite-supported carburized molybdenum catalystsAngela S Rocha, Victor Teixeira da Silva, Jean G Eon, et al.
Physical Chemistry Chemical Physics : PCCP|October 5, 2018
Fragment and cluster ions from gaseous and condensed pyridine produced under electron impactFabio de A Ribeiro, Benedikt Rudek, Henrique B A Cerqueira, et al.
The Journal of Physical Chemistry. A|July 25, 2020
Structure, Stability, and Spectroscopic Properties of Small Acetonitrile Cation ClustersHenrique B A Cerqueira, Julia C Santos, Felipe Fantuzzi, et al.
Pageof 2

Showing results (11-20 of 18) with videos related to

Sort By:
Pageof 2
You have reached the last page of results.This site can display upto 18 results.
The Journal of Physical Chemistry. A|March 30, 2023
Revisiting the Spectrum of Co(CN)<sub>6</sub><sup>3-</sup>: The Role of Correlation, Solvation, and Vibronic and Spin-Orbit CouplingsAmanda D Torres, Marcos A S Francisco, Ricardo R Oliveira, et al.
Journal of Molecular Modeling|August 11, 2022
Comparison among several vibronic coupling methodsAmanda D Torres, Carlos E V de Moura, Ricardo R Oliveira, et al.
Physical Chemistry Chemical Physics : PCCP|September 19, 2023
Gas-phase C<sub>60</sub>H<sub></sub><sup>+</sup> (<i>n</i> = 0-4, <i>q</i> = 0,1) fullerenes and fulleranes: spectroscopic simulations shed light on cosmic molecular structuresRicardo R Oliveira, Germán Molpeceres, Ricardo Montserrat, et al.
The Journal of Physical Chemistry. B|March 17, 2011
Ab initio simulation of changes in geometry, electronic structure, and Gibbs free energy caused by dehydration of hydrotalcites containing Cl⁻ and CO₃²⁻ counteranionsDeyse G Costa, Alexandre B Rocha, Wladmir F Souza, et al.
The Journal of Physical Chemistry. A|June 15, 2010
Theoretical investigation on the stability of negatively charged formic acid clustersLeonardo Baptista, Diana P P Andrade, Alexandre B Rocha, et al.
The Journal of Physical Chemistry. B|August 11, 2006
Characterization by 27Al NMR, X-ray absorption spectroscopy, and density functional theory techniques of the species responsible for benzene hydrogenation in Y zeolite-supported carburized molybdenum catalystsAngela S Rocha, Victor Teixeira da Silva, Jean G Eon, et al.
Physical Chemistry Chemical Physics : PCCP|October 5, 2018
Fragment and cluster ions from gaseous and condensed pyridine produced under electron impactFabio de A Ribeiro, Benedikt Rudek, Henrique B A Cerqueira, et al.
The Journal of Physical Chemistry. A|July 25, 2020
Structure, Stability, and Spectroscopic Properties of Small Acetonitrile Cation ClustersHenrique B A Cerqueira, Julia C Santos, Felipe Fantuzzi, et al.
Pageof 2