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The Journal of Chemical Physics|September 1, 2014
Charge-transfer excitations in low-gap systems under the influence of solvation and conformational disorder: exploring range-separation tuningThiago B de Queiroz, Stephan Kümmel
The Journal of Chemical Physics|July 24, 2015
Tuned range separated hybrid functionals for solvated low bandgap oligomersThiago B de Queiroz, Stephan Kümmel
The Journal of Chemical Physics|July 15, 2024
Screened optimally tuned range separated hybrid functional for solvated low bandgap molecular systemsReinaldo V Dantas Filho, Thiago B de Queiroz
Physical Chemistry Chemical Physics : PCCP|November 10, 2025
Optically induced charge separation at the naphthalenediimide-phenothiazine interfaceThomas Trepl, Renan G de Assis, Christine M Isborn, et al.
The Journal of Physical Chemistry Letters|November 26, 2019
Controlling the Activation Energy for Single-Ion Diffusion through a Hybrid Polyelectrolyte Matrix by Manipulating the Central Coordinate Semimetal AtomVictoria C Ferrari, Raphael S Alvim, Thiago B de Queiroz, et al.
The Journal of Chemical Physics|January 30, 2021
First principles theoretical spectroscopy of methylene blue: Between limitations of time-dependent density functional theory approximations and its realistic description in the solventThiago B de Queiroz, Erick R de Figueroa, Maurício D Coutinho-Neto, et al.
RSC Advances|May 6, 2022
Gold nanochannels oxidation by confined waterAndré M Batista, Thiago B de Queiroz, Renato A Antunes, et al.
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