Zobrazeno 1 - 9
of 9
pro vyhledávání: '"Enrique Poulain"'
Autor:
Oscar Olvera-Neria, Raúl García-Cruz, Julio Gonzalez-Torres, Luz María García-Cruz, Jean Luis Castillo-Sánchez, Enrique Poulain
Publikováno v:
International Journal of Photoenergy, Vol 2024 (2024)
An evolutionary algorithm was employed to locate the global minimum of TiO2n nanoparticles with n=2–20. More than 61,000 structures were calculated with a semiempirical method and reoptimized using density functional theory. The exciton binding ene
Externí odkaz:
https://doaj.org/article/f5e7598bb16b4c43b9a6b64e5ea3c2d6
Autor:
Julio César González-Torres, Enrique Poulain, Víctor Domínguez-Soria, Raúl García-Cruz, Oscar Olvera-Neria
Publikováno v:
International Journal of Photoenergy, Vol 2018 (2018)
Anatase TiO2 presents a large bandgap of 3.2 eV, which inhibits the use of visible light radiation (λ > 387 nm) for generating charge carriers. We studied the activation of TiO2 (101) anatase with visible light by doping with C, N, S, and F atoms. F
Externí odkaz:
https://doaj.org/article/fecd002226a348ecb899f61a896c746a
Autor:
Oscar Olvera-Neria, Raúl García-Cruz, Víctor Domínguez-Soria, Luz María García-Cruz, Julio Gonzalez-Torres, Enrique Poulain
Publikováno v:
SSRN Electronic Journal.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2c8c2051cbf5f330ad493d285680c67d
https://doi.org/10.2139/ssrn.4313992
https://doi.org/10.2139/ssrn.4313992
Autor:
Raúl García-Cruz, Julio Gonzalez-Torres, Arnulfo Montoya-Moreno, Víctor Domínguez-Soria, Héctor Luna-García, Enrique Poulain, J.S. Arellano, Oscar Olvera-Neria
Publikováno v:
Chemical Physics. 556:111462
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::07b3c938234fbc390736e30b6ae56f86
https://doi.org/10.1016/j.chemphys.2022.111462
https://doi.org/10.1016/j.chemphys.2022.111462
Autor:
Julio César, González-Torres, Luis A, Cipriano, Enrique, Poulain, Víctor, Domínguez-Soria, Raúl, García-Cruz, Oscar, Olvera-Neria
Publikováno v:
Journal of molecular modeling. 24(10)
Charge carriers (electrons and holes) are generated on the TiO
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::0146ab86623a86f630b19ddf660461b2
https://pubmed.ncbi.nlm.nih.gov/30194488
https://pubmed.ncbi.nlm.nih.gov/30194488
Autor:
Raúl, García-Cruz, Enrique, Poulain, Isaías, Hernández-Pérez, Juan A, Reyes-Nava, Julio C, González-Torres, A, Rubio-Ponce, Oscar, Olvera-Neria
Publikováno v:
The journal of physical chemistry. A. 121(32)
To dispose of atomic oxygen, it is necessary the O
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::ac4c35e7b2e49375a356d6d050129d18
https://pubmed.ncbi.nlm.nih.gov/28678482
https://pubmed.ncbi.nlm.nih.gov/28678482
Autor:
Virineya Bertin, Gloria Del Ángel, Marco A. Mora, Enrique Poulain, Oscar Olvera, Roberto López Rendón
Publikováno v:
Universidad Autónoma Metropolitana
UAM
Redalyc-UAM
Journal of the Mexican Chemical Society (México) Num.1 Vol.52
UAM
Redalyc-UAM
Journal of the Mexican Chemical Society (México) Num.1 Vol.52
In this work, theoretically adsorption of N, O, NO, as well as the possible spontaneous dissociation of NO on the small cluster of Pd4 is studied. We used the theory of density functional. The main purpose is to have a reference for further study of
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::037483f2abbe2f533de41e8f778161ab
https://www.redalyc.org/articulo.oa?id=47552114
https://www.redalyc.org/articulo.oa?id=47552114
