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Alejandro F. Maldonado

Observed names: A. F. Maldonado, Alejandro Fabian Maldonado, Alejandro Fabián Maldonado, Alejandro Maldonado, Maldonado, Alejandro F., Maldonado, Alejandro Fabián
ORCID: 0000-0003-3587-3736
Observed ORCID: 0000-0003-3587-3736
OpenAlex ID: A5032788720
Polarization propagators: A powerful theoretical tool for a deeper understanding of NMR spectroscopic parameters
2010 · Gustavo A. Aucar, Rodolfo H. Romero, et al. · International Reviews in Physical Chemistry · 103
The UKB prescription and the heavy atom effects on the nuclear magnetic shielding of vicinal heavy atoms
2009 · Alejandro F. Maldonado, Gustavo A. Aucar · Physical Chemistry Chemical Physics · 75
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Relativistic and Electron-Correlation Effects on the Nuclear Magnetic Resonance Shieldings of Molecules Containing Tin and Lead Atoms
2014 · Alejandro F. Maldonado, Gustavo A. Aucar · The Journal of Physical Chemistry A · 38
Relativistic effects on the shielding of SnH2XY and PbH2XY (X, Y = F, Cl, Br and I) heavy atom–containing molecules
2011 · Juan I. Melo, Alejandro Maldonado, et al. · Theoretical Chemistry Accounts · 35
Relativistic effects on group-12 metal nuclear shieldings
2011 · Juho Roukala, Alejandro F. Maldonado, et al. · Physical Chemistry Chemical Physics · 35
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Core-dependent and ligand-dependent relativistic corrections to the nuclear magnetic shieldings in MH4−n Y n (n = 0–4; M = Si, Ge, Sn, and Y = H, F, Cl, Br, I) model compounds
2014 · Alejandro F. Maldonado, Gustavo A. Aucar, et al. · Journal of Molecular Modeling · 34
Foundations of the LRESC model for response properties and some applications
2017 · Gustavo A. Aucar, Juan I. Melo, et al. · International Journal of Quantum Chemistry · 29
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Microsolvation of methylmercury: structures, energies, bonding and NMR constants ( 199 Hg, 13 C and 17 O)
2015 · Edison Flórez, Alejandro F. Maldonado, et al. · Physical Chemistry Chemical Physics · 25
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Theoretical developments and applications of polarization propagators
2018 · Gustavo A. Aucar, Alejandro F. Maldonado, et al. · International Journal of Quantum Chemistry · 22
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Relativistic effects on the nuclear magnetic shieldings of rare-gas atoms and halogen in hydrogen halides within relativistic polarization propagator theory
2005 · Sergio S. Gomez, Alejandro Maldonado, et al. · The Journal of Chemical Physics · 22
Theoretical analysis of NMR shieldings of group-11 metal halides on MX (M = Cu, Ag, Au; X = H, F, Cl, Br, I) molecular systems, and the appearance of quasi instabilities on AuF
2015 · Alejandro F. Maldonado, Juan I. Melo, et al. · Physical Chemistry Chemical Physics · 19
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Nuclear charge-distribution effects on the NMR spectroscopy parameters
2012 · Alejandro F. Maldonado, Carlos A. Giménez, et al. · The Journal of Chemical Physics · 19
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The appearance of an interval of energies that contain the whole diamagnetic contribution to NMR magnetic shieldings
2007 · Alejandro Maldonado, Gustavo A. Aucar · The Journal of Chemical Physics · 18
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Relativistic and electron correlation effects on NMR J-coupling of Sn and Pb containing molecules
2016 · C. A. Giménez, A. F. Maldonado, et al. · Theoretical Chemistry Accounts · 17
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Relativistic effects on nuclear magnetic shieldings of CHnX4−n and CHXYZ (X, Y, Z = H, F, Cl, Br, I)
2012 · Juan I. Melo, Alejandro F. Maldonado, et al. · The Journal of Chemical Physics · 17
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Microsolvation of heavy halides
2020 · Yuly Chamorro, Edison Flórez, et al. · International Journal of Quantum Chemistry · 16
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NMR espectroscopic parameters of HX and Si(Sn)X4 (X=H, F, Cl, Br and I) and SnBr4−nIn model compounds
2011 · Alejandro F. Maldonado, Carlos A. Gimenez, et al. · Chemical Physics · 15
Relativistic corrections to the electric field gradient given by linear response elimination of the small component formalism
2019 · Juan I. Melo, Alejandro F. Maldonado · International Journal of Quantum Chemistry · 13
Coordination of Mercury(II) in Water Promoted over Hydrolysis in Solvated Clusters [Hg(H 2 O) 1–6 ] (aq) 2+ : Insights from Relativistic Effects and Free Energy Analysis
2023 · Edison Florez, Andy D. Zapata-Escobar, et al. · The Journal of Physical Chemistry A · 12
NMR Magnetic Shielding in Transition Metal Compounds Containing Cadmium, Platinum, and Mercury
2023 · Andy Danian Zapata-Escobar, Alejandro Fabian Maldonado, et al. · Magnetochemistry · 11
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The LRESC-Loc Model to Analyze Magnetic Shieldings with Localized Molecular Orbitals
2022 · Andy D. Zapata−Escobar, Alejandro F. Maldonado, et al. · The Journal of Physical Chemistry A · 10
Performance of the LRESC Model on top of DFT Functionals for Relativistic NMR Shielding Calculations
2019 · Juan I. Melo, Alejandro F. Maldonado, et al. · Journal of Chemical Information and Modeling · 10
Microsolvation of Sr2+, Ba2+: Structures, energies, bonding, and nuclear magnetic shieldings
2021 · Angie Velásquez, Yuly Chamorro, et al. · International Journal of Quantum Chemistry · 9
High order relativistic corrections on the electric field gradient within the LRESC formalism
2022 · Juan J. Aucar, Alejandro F. Maldonado, et al. · The Journal of Chemical Physics · 8
Relativistic corrections of the electric field gradient in dihalogen molecules XY ( X , Y = F, Cl, Br, I, At) within the linear response elimination of the small component formalism
2021 · Juan J. Aucar, Alejandro F. Maldonado, et al. · International Journal of Quantum Chemistry · 8
Works count: 45
Citation count: 645
H-index: 16
I10-index: 22
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