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Alexandre B. Rocha | Researchclopedia

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Alexandre B. Rocha

Universidade Federal do Rio de Janeiro ORCID

149

Works

1,755

Citations

22

h-index

60

i10-index

Research Topics

Advanced Chemical Physics Studies Atomic and Molecular Physics Photochemistry and Electron Transfer Studies

Affiliations

Universidade Federal de Juiz de Fora2008–2010

Universidade Estadual do Ceará2019–2021

Universidade Federal de Minas Gerais2012–2012

San Antonio College2023–2023

Universidade Federal do Rio de Janeiro1998–2025

Top Works

Comparative Structural, thermodynamic and electronic analyses of ZnAlAn− hydrotalcite-like compounds (An−Cl−, F−, Br−, OH−, CO32− or NO3−): An ab initio study

Deyse G. Costa,Alexandre B. Rocha,et al.

2011172 citations

Spectroscopy and Quantum Chemical Studies

Spectroscopy and Laser Applications

Structural Model Proposition and Thermodynamic and Vibrational Analysis of Hydrotalcite-Like Compounds by DFT Calculations

Deyse G. Costa,Alexandre B. Rocha,et al.

201094 citations

On the nature of inhibition performance of imidazole on iron surface

Juliana O. Mendes,Edilson C. da Silva,et al.

201166 citations

Ab Initio Simulation of Changes in Geometry, Electronic Structure, and Gibbs Free Energy Caused by Dehydration of Hydrotalcites Containing Cl<sup>−</sup>and CO<sub>3</sub><sup>2−</sup>Counteranions

Deyse G. Costa,Alexandre B. Rocha,et al.

201155 citations

Molecular inner-shell photoabsorption/photoionization cross sections at core-valence-separated coupled cluster level: Theory and examples

Bruno Nunes Cabral Tenorio,Torsha Moitra,et al.

201954 citations

Benzene adsorption on Mo2C: A theoretical and experimental study

Ângela Sanches Rocha,Alexandre B. Rocha,et al.

201047 citations

Potential curves for inner-shell states of CO calculated at multiconfigurational self-consistent field level

Alexandre B. Rocha

201140 citations

Ab Initio Study of Reaction Pathways Related to Initial Steps of Thermal Decomposition of the Layered Double Hydroxide Compounds

Deyse G. Costa,Alexandre B. Rocha,et al.

201236 citations

Charge Transfer Dynamics and Molecular Orientation Probed by Core Electron Spectroscopies on thermal-annealed Polysilafluorene Derivative: Experimental and Theoretical Approaches

Yunier Garcia‐Basabe,Cleber F. N. Marchiori,et al.

201434 citations