Unveiling the spectroscopy of 2-(nitromethylene) imidazolidine: From experimental findings to theoretical insights RS da Silva, LR Ventura, AE Santos, CE Fellows, EA Ferreira, DP Sangi Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 128072 , 2026 2026
Designing Diaryl Sulfide Electronic Properties: A Comprehensive DFT Guide to HOMO–LUMO Gaps and Reactivity Descriptors RS da Silva ACS Omega , 2026 2026
Synergistic Experimental and Theoretical Studies on Pesticide Detection in River samples Using Faujasite-CTAB Modified Carbon Paste Electrode CCCM Barbosa, BL Ramos, EA Ferreira, RG Amorim, RS da Silva, ... Water, Air, & Soil Pollution 237 (2), 1-23 , 2026 2026 Citations: 1
Spectroscopic characterization of NH (A3Π): Linewidths and energy level shifts RS da Silva, MDS Alves, SR Souza, CE Fellows Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 127179 , 2025 2025 Citations: 1
Correction: Thermophysical Properties of Alkali Metals: A Partition Function Theory Approach Including Low-Lying Electronic States CD da Silva, MDS Alves, RS da Silva, MY Ballester International Journal of Thermophysics 46 (11), 162 , 2025 2025
Dual Pathways, One Framework: Theoretical Insights into the Benzimidazole × Benzodiazepine Crossroads from o -Phenylenediamine and 2-Cyanoacrylate … RS da Silva, AJF Souza, DP Sangi, RG Amorim ACS Omega , 2025 2025 Citations: 1
Beyond Lennard-Jones and Morse Potentials: Advanced Analytic Potentials Unraveling the Thermophysical Properties of Alkali Metals MDS ALVES, CD Silva, RS Sousa da Silva, MY Ballester Physica Scripta , 2025 2025 Citations: 2
Thermophysical Properties of Alkali Metals: A Partition Function Theory Approach Including Low-Lying Electronic States CD da Silva, MDS Alves, RS da Silva, MY Ballester 2025 Citations: 1
DFT study of the structure and IR spectrum of 2-isopropylphenyl 2-nitro-4-(( E )-((4-acetylpiperazin-1-yl)carbonyl)ethenyl)phenyl sulfide R S. da Silva Phosphorus, Sulfur, and Silicon and the Related Elements, 1-15 , 2025 2025 Citations: 2
Energy shifts in predissociating levels of diatomic molecules: The case of N (C ) and N (1 ) interacting states LR Ventura, RS da Silva, SR Souza, J Amorim, CE Fellows arXiv preprint arXiv:2504.10780 , 2025 2025 Citations: 1
New look at perturbations in the N2 (C3Πu, v) electronic state. Indirect predissociation through states C′′ 5Πu and 17Σu+ states LR Ventura, RS da Silva, J Amorim, CE Fellows Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 125986 , 2025 2025 Citations: 2
The role of spin-orbit perturbations in the rovibrational structure of the N2 (C3Πu, v) electronic state. Importance in N (4S) and N (2D) formation in Lewis-Rayleigh afterglows LR Ventura, RS da Silva, CE Fellows, J Amorim Physica Scripta 100 (3), 035609 , 2025 2025
Understanding 2-(Nitromethylene) hexahydropyrimidin-5-ol Reaction Processes and NMR Spectroscopy: A Theoretical and Experimental Investigation RS da Silva, DP Sangi, RG Amorim ACS Omega , 2024 2024 Citations: 3
Transition probabilities and radiative lifetimes of C2−: A high level theoretical investigation RS da Silva Journal of Quantitative Spectroscopy and Radiative Transfer, 109000 , 2024 2024 Citations: 7
A new look at N2+ electronic transitions: An experimental and theoretical study LR Ventura, RS da Silva, J Amorim, CE Fellows Journal of Molecular Spectroscopy, 111902 , 2024 2024 Citations: 2
High Efficiency of Myclobutanil Adsorption by CTAB-zeolite Structures: Experimental Evidence Meets Theoretical Investigation CS Moraes, PA Carneiro, DN Faria, DF Cipriano, JCC Freitas, RG Amorim, ... Silicon, 1-17 , 2024 2024 Citations: 9
Transition probabilities of the AgS (A2Σ+→ X2Π) emission including spin-orbit coupling effects and evidence of a novel band system RS da Silva, MY Ballester Journal of Quantitative Spectroscopy and Radiative Transfer, 108789 , 2023 2023
Brand new aspects of the a4Σu+→ X2Σg+ transition probabilities in N2+ RS da Silva, LR Ventura, CE Fellows, J Amorim Journal of Quantitative Spectroscopy and Radiative Transfer, 108746 , 2023 2023 Citations: 4
Prediction of a new spin-forbidden transition in the N2 molecule-C′′ 5Πu→ B3Πg B Minaev, RS da Silva, O Panchenko, H Ågren Journal of Quantitative Spectroscopy and Radiative Transfer, 108701 , 2023 2023 Citations: 5
New analysis of the 12C16O+ (B2Σ+-X2Σ+) system: Spin-orbit and spin-rotation coupling of the X2Σ+ state RS da Silva, LR Ventura, MY Ballester, CE Fellows Journal of Quantitative Spectroscopy and Radiative Transfer, 108668 , 2023 2023 Citations: 4
MOST CITED SCHOLAR PUBLICATIONS
A novel investigation of the N2 (C3Πu− B3Πg) and N2 (C ″5Πu− A′ 5Σg+) band systems using accurate functional forms RS da Silva, LR Ventura, CE Fellows, MY Ballester Journal of Quantitative Spectroscopy and Radiative Transfer, 107130 , 2020 2020 Citations: 27
Theoretical study of the spin-orbit coupling in the X2Π state of NO RS da Silva, MY Ballester, LR Ventura, CE Fellows Chemical Physics Letters, 138896 , 2021 2021 Citations: 22
Potential enegy cuves, tuning points, Fanck–Condon factos and $$-centoids fo the astophysically inteesting S2 molecule RS da Silva, MY Ballester Astrophysics and Space Science 364 (10), 169 , 2019 2019 Citations: 16
Theoretical study of the low-lying doublet and quartet electronic states of 7Li16O molecule including spin-orbit coupling effect and a new limit to the adiabatic ionization energy RS da Silva, MY Ballester Chemical Physics, 111123 , 2021 2021 Citations: 13
A comparative study of analytic representations of potential energy curves for O 2 , N 2 , and SO in their ground electronic states JP Araújo, MD Alves, RS da Silva, MY Ballester Journal of Molecular Modeling 25 (7), 198 , 2019 2019 Citations: 13
A quasi-classical study of energy transfer in collisions of hyperthermal H atoms with SO 2 molecules RS da Silva, JD Garrido, MY Ballester The Journal of chemical physics 147 (8), 084308 , 2017 2017 Citations: 13
Prediction of new spin-forbidden transitions in the N2 molecule-the electric dipole A′ 5Σg+→ A3Σu+ and magnetic dipole a′ 1Σu⎯← A3Σu+ transitions BF Minaev, RS Da Silva, O Panchenko, H Ågren The Journal of Chemical Physics , 2023 2023 Citations: 12
Revisiting 12C16O+ First Negative System: an experimental and theoretical study. LR Ventura, RS da Silva, MY Ballester, CE Fellows Journal of Quantitative Spectroscopy and Radiative Transfer, 107312 , 2020 2020 Citations: 10
High Efficiency of Myclobutanil Adsorption by CTAB-zeolite Structures: Experimental Evidence Meets Theoretical Investigation CS Moraes, PA Carneiro, DN Faria, DF Cipriano, JCC Freitas, RG Amorim, ... Silicon, 1-17 , 2024 2024 Citations: 9
A theoretical study of energy transfer in Ar( 1 S) + SO 2 ( ′) collisions: Cross sections and rate coefficients for vibrational transitions RS da Silva, MY Ballester The Journal of Chemical Physics 149 (14), 144309 , 2018 2018 Citations: 9
Transition probabilities and radiative lifetimes of C2−: A high level theoretical investigation RS da Silva Journal of Quantitative Spectroscopy and Radiative Transfer, 109000 , 2024 2024 Citations: 7
Radiative lifetimes of the doublet states of 107Ag16O: A configuration interaction study RS da Silva, MY Ballester Chemical Physics, 111480 , 2022 2022 Citations: 6
Infrared radiative transition probabilities for the LiS (A2) Σ+-X2 Π) band system RS da Silva, MY Ballester Chemical Physics, 110935 , 2020 2020 Citations: 6
Prediction of a new spin-forbidden transition in the N2 molecule-C′′ 5Πu→ B3Πg B Minaev, RS da Silva, O Panchenko, H Ågren Journal of Quantitative Spectroscopy and Radiative Transfer, 108701 , 2023 2023 Citations: 5
Brand new aspects of the a4Σu+→ X2Σg+ transition probabilities in N2+ RS da Silva, LR Ventura, CE Fellows, J Amorim Journal of Quantitative Spectroscopy and Radiative Transfer, 108746 , 2023 2023 Citations: 4
New analysis of the 12C16O+ (B2Σ+-X2Σ+) system: Spin-orbit and spin-rotation coupling of the X2Σ+ state RS da Silva, LR Ventura, MY Ballester, CE Fellows Journal of Quantitative Spectroscopy and Radiative Transfer, 108668 , 2023 2023 Citations: 4
A theoretical investigation of the SO (B-3 Sigma (-)-X-3 Sigma (-)) vibronic transition using accurate analytical potential energy functions RS da Silva, MY Ballester THEORETICAL CHEMISTRY ACCOUNTS 139 (3) , 2020 2020 Citations: 4
Understanding 2-(Nitromethylene) hexahydropyrimidin-5-ol Reaction Processes and NMR Spectroscopy: A Theoretical and Experimental Investigation RS da Silva, DP Sangi, RG Amorim ACS Omega , 2024 2024 Citations: 3
Multireference configuration interaction calculations on the FeS molecule RS da Silva, MY Ballester Molecular Physics, e2096142 , 2022 2022 Citations: 3
Beyond Lennard-Jones and Morse Potentials: Advanced Analytic Potentials Unraveling the Thermophysical Properties of Alkali Metals MDS ALVES, CD Silva, RS Sousa da Silva, MY Ballester Physica Scripta , 2025 2025 Citations: 2
