Zobrazeno 1 - 10
of 45
pro vyhledávání: '"Aned de Leon"'
Publikováno v:
Acta Chimica Slovenica, Vol 67, Iss 4, Pp 1196-1201 (2020)
This work focused on comparing cadmium sulphide (CdS) thin films with and without CdS silver aggregates (CdS:Ag) deposited on the surface. We report absorption and transmission responses. Using the Tauc method, we obtained direct band gap energies wi
Externí odkaz:
https://doaj.org/article/001da82ea3644e6297d7b015881d3364
Autor:
Armando G Rojas-Hernandez, Aned De Leon, Rafael A Sabory-Garcia, Rafael Ramirez-Bon, Dainet Berman-Mendoza, Santos J Castillo
Publikováno v:
Acta Chimica Slovenica, Vol 67, Iss 1, Pp 319-324 (2020)
Theoretical studies on conformational analysis, geometry optimizations and frequencies for citrate at the MP2/LANL2DZ level portrait it as a promising candidate for a complexing agent for cadmium (II) ion (Cd2+) and cadmium sulfide (CdS). Natural Bon
Externí odkaz:
https://doaj.org/article/39bd1a63055d4a6fbcf3c64f3786dcba
Autor:
Carlos Emiliano Buelna-García, Cesar Castillo-Quevedo, Jesus Manuel Quiroz-Castillo, Edgar Paredes-Sotelo, Manuel Cortez-Valadez, Martha Fabiola Martin-del-Campo-Solis, Tzarara López-Luke, Marycarmen Utrilla-Vázquez, Ana Maria Mendoza-Wilson, Peter L. Rodríguez-Kessler, Alejandro Vazquez-Espinal, Sudip Pan, Aned de Leon-Flores, Jhonny Robert Mis-May, Adán R. Rodríguez-Domínguez, Gerardo Martínez-Guajardo, Jose Luis Cabellos
Publikováno v:
Frontiers in Chemistry, Vol 10 (2022)
The relative populations of Cu38 isomers depend to a great extent on the temperature. Density functional theory and nanothermodynamics can be combined to compute the geometrical optimization of isomers and their spectroscopic properties in an approxi
Externí odkaz:
https://doaj.org/article/c839998fa109483bacc1951af8cee9a4
Publikováno v:
Eclética Química, Vol 31, Iss 3, Pp 15-21 (2018)
Molecular modelling using semiempirical methods AM1, PM3, PM5 and, MINDO as well as the Density Functional Theory method BLYP/DZVP respectively were used to calculate the struc- ture and vibrational spectra of d-glucose and d-fructose in their open c
Externí odkaz:
https://doaj.org/article/289f8da48c4449fa8472c0c4cb5d6a7e
Autor:
R. Ochoa-Landín, Santos Jesús Castillo, Angel Roberto Torres-Duarte, Aned de Leon, Horacio Antolín Pineda-Leon
Publikováno v:
Acta Chimica Slovenica, Vol 67, Iss 4, Pp 1196-1201 (2020)
This work focused on comparing cadmium sulphide (CdS) thin films with and without CdS silver aggregates (CdS:Ag) deposited on the surface. We report absorption and transmission responses. Using the Tauc method, we obtained direct band gap energies wi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::12ee5622978b0c464308d7a3489b40d0
https://journals.matheo.si/index.php/ACSi/article/view/6095
https://journals.matheo.si/index.php/ACSi/article/view/6095
Autor:
D. Berman-Mendoza, Rafael Ramírez-Bon, Armando G. Rojas-Hernández, Aned de Leon, Rafael A. Sabory-García, Santos Jesús Castillo
Publikováno v:
Acta Chimica Slovenica, Vol 67, Iss 1, Pp 319-324 (2020)
Theoretical studies on conformational analysis, geometry optimizations and frequencies for citrate at the MP2/LANL2DZ level portrait it as a promising candidate for a complexing agent for cadmium (II) ion (Cd 2+ ) and cadmium sulfide (CdS). Natural B
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2a586ef3c739d009fb4130cd9afdd303
https://doi.org/10.17344/acsi.2019.5534
https://doi.org/10.17344/acsi.2019.5534
Autor:
Carlos Emiliano, Buelna-García, Cesar, Castillo-Quevedo, Jesus Manuel, Quiroz-Castillo, Edgar, Paredes-Sotelo, Manuel, Cortez-Valadez, Martha Fabiola, Martin-Del-Campo-Solis, Tzarara, López-Luke, Marycarmen, Utrilla-Vázquez, Ana Maria, Mendoza-Wilson, Peter L, Rodríguez-Kessler, Alejandro, Vazquez-Espinal, Sudip, Pan, Aned, de Leon-Flores, Jhonny Robert, Mis-May, Adán R, Rodríguez-Domínguez, Gerardo, Martínez-Guajardo, Jose Luis, Cabellos
Publikováno v:
Frontiers in chemistry. 10
The relative populations of Cu
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::21a95bcd6449fbc817f4312efa791e4c
https://pubmed.ncbi.nlm.nih.gov/35300385
https://pubmed.ncbi.nlm.nih.gov/35300385
Autor:
Cesar, Castillo-Quevedo, Carlos Emiliano, Buelna-Garcia, Edgar, Paredes-Sotelo, Eduardo, Robles-Chaparro, Edgar, Zamora-Gonzalez, Martha Fabiola, Martin-Del-Campo-Solis, Jesus Manuel, Quiroz-Castillo, Teresa, Del-Castillo-Castro, Gerardo, Martínez-Guajardo, Aned, de-Leon-Flores, Manuel, Cortez-Valadez, Filiberto, Ortiz-Chi, Tulio, Gaxiola, Santos Jesus, Castillo, Alejandro, Vásquez-Espinal, Sudip, Pan, Jose Luis, Cabellos
Publikováno v:
Molecules
In this study, we report the lowest energy structure of bare Cu13 nanoclusters as a pair of enantiomers at room temperature. Moreover, we compute the enantiomerization energy for the interconversion from minus to plus structures in the chiral putativ
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::7fd2ef13f1e24b60415b702cc6bdadbd
https://pubmed.ncbi.nlm.nih.gov/34577181
https://pubmed.ncbi.nlm.nih.gov/34577181
Autor:
Armando G, Rojas-Hernandez, Aned de, Leon, Rafael A, Sabory-Garcia, Rafael, Ramirez-Bon, Dainet, Berman-Mendoza, Santos J, Castillo
Publikováno v:
Acta chimica Slovenica. 67(1)
Theoretical studies on conformational analysis, geometry optimizations and frequencies for citrate at the MP2/LANL2DZ level portrait it as a promising candidate for a complexing agent for cadmium (II) ion (Cd2+) and cadmium sulfide (CdS). Natural Bon
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::99afb8bad5c7219c8aa48496b6b97184
https://pubmed.ncbi.nlm.nih.gov/33558934
https://pubmed.ncbi.nlm.nih.gov/33558934
Autor:
Jesus Manuel Quiroz-Castillo, Gerardo Martínez-Guajardo, G. Anzueto-Sánchez, Carlos Emiliano Buelna-Garcia, Martha Fabiola Martin-del-Campo-Solis, José Luis Cabellos, Aned de-Leon-Flores, Cesar Castillo-Quevedo
Publikováno v:
Materials
Volume 14
Issue 1
Materials, Vol 14, Iss 112, p 112 (2021)
Volume 14
Issue 1
Materials, Vol 14, Iss 112, p 112 (2021)
The starting point to understanding cluster properties is the putative global minimum and all the nearby local energy minima
however, locating them is computationally expensive and difficult. The relative populations and spectroscopic properties
however, locating them is computationally expensive and difficult. The relative populations and spectroscopic properties
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::abf5ebd98eee02f16198e2154229be6f
http://arxiv.org/abs/2101.00369
http://arxiv.org/abs/2101.00369
