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Page 1
DFT Study of Adsorption Behavior of Nitro Species on Carbon-Doped Boron Nitride Nanoribbons for Toxic Gas Sensing.
Nanomaterials (Basel). 2023 Apr 19;13(8):1410. doi: 10.3390/nano13081410.
Nanomaterials (Basel). 2023.
PMID: 37110995
Free PMC article.
Binary adsorption isotherms of methylene blue and crystal violet on mandarin peels: prediction via detailed multivariate calibration and density functional theory (DFT) calculations.
Lima JP, Besegatto SV, Villanueva-Mejia F, García-Hernández E, Bonilla-Petriciolet A, Lopes TJ.
Lima JP, et al. Among authors: villanueva mejia f.
Environ Sci Pollut Res Int. 2023 Aug;30(40):92436-92450. doi: 10.1007/s11356-023-28873-3. Epub 2023 Jul 25.
Environ Sci Pollut Res Int. 2023.
PMID: 37490251
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Reactivity of Atomically Functionalized C-Doped Boron Nitride Nanoribbons and Their Interaction with Organosulfur Compounds.
Villanueva-Mejia F, Navarro-Santos P, Rodríguez-Kessler PL, Herrera-Bucio R, Rivera JL.
Villanueva-Mejia F, et al.
Nanomaterials (Basel). 2019 Mar 18;9(3):452. doi: 10.3390/nano9030452.
Nanomaterials (Basel). 2019.
PMID: 30889813
Free PMC article.
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Electronic properties and reactivity of oxidized graphene nanoribbons and their interaction with phenol.
Guevara-Martínez SJ, Villanueva-Mejia F, Olmos L, Navarro-Santos P, Arroyo-Albiter M.
Guevara-Martínez SJ, et al. Among authors: villanueva mejia f.
J Mol Model. 2021 Dec 30;28(1):23. doi: 10.1007/s00894-021-05002-w.
J Mol Model. 2021.
PMID: 34970722
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