Yoshio Barrera
PhD Computational/Theoretical Chemistry
About Me
Hi! I'm Yoshio, an enthusiastic and motivated PhD in Chemistry.
I have a deep curiosity and interest in Chemical Reactivity, Quantum Tunneling, Solid State Chemistry, and Machine Learning.
Education
B.S. Chemistry
CUCEI - UdeG
Feb 2011 - Jun 2015
M.Sc. Physical Chemistry
CINVESTAV Merida - IPN
Aug 2016 - Aug 2018
Ph.D. Chemistry
Institute of Chemistry - UNAM
Aug 2020 - Nov 2024
Research
All
CDFT/Radical
GC-CDFT
EF
DiRadicals
Lewis Acidis
Iron Complexes
NOESY
Aleksey Kovalev, Konstantin Belov, Yoshio Barrera, Savaş Kaya & Ilya Khodov - 2026
Syn–Anti Conformational Equilibrium of Indomethacin: A Combined NOESY and Quantum Chemical Study
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Y. Barrera and F. F. Mulks - 2026
Gauging the double Lewis acidity of dicationic molecules with oxide and fluoride ion affinities
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A. Taddele, G. Kassahun, Y. Zewdu, G. Sitotaw, T. A. Chekol, Y. Barrera, S. Kaya, E. C. Buluz, G. T. Tigineh and A. Abebe - 2026
Synthesis, characterization, and biological evaluation of ternary Fe(III) mixed-ligand complexes: Combined experimental and theoretical studies
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Y. Barrera, T. Rocha-Rinza, F. F. Mulks, P. W. Ayers and J. S. M. Anderson - 2025
The Grand Canonical General-Purpose Reactivity Indicator
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Y. Barrera and F. F. Mulks - 2025
Strained diradicaloids for σ-bond-insertion reactions: A breakthrough in drug discovery
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Y. Barrera and J. S. M. Anderson - 2024
Does the radical GPRI and radical Fukui function depend on the population scheme?
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Y. Barrera, A. Kawasaki, P. W. Ayers and J. S. M. Anderson - 2023
An Overview of the Ehrenfest Force with New Insights into Its Properties
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Y. Barrera and J. S. M. Anderson - 2023
Chapter Review of the Perturbative and General-Purpose Reactivity Indicator Models
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Y. Barrera and J. S. M. Anderson - 2022