Zobrazeno 1 - 7
of 7
pro vyhledávání: '"Augusto César Azevedo Silva"'
Autor:
Francinaldo dos Santos Leite, Augusto César Azevedo Silva, Caio Vinícius Caetano, Adilson Luís Pereira Silva, Jaldyr de Jesus Gomes Varela Júnior
Publikováno v:
Orbital: The Electronic Journal of Chemistry, Vol 13, Iss 3 (2021)
In this work, we explored the energy landscape and the effect of increasing the amount of Ag atoms over the segregation of Cu atoms in bimetallic clusters with compositions Cu3Agm (), using a genetic algorithm coupled with the Gupta potential to dete
Externí odkaz:
https://doaj.org/article/e7fec7b5c7a845c0a9a11868f3f95b2b
Autor:
Mesaque Carvalho França, Rayse Machado Ferreira, Fellipe dos Santos Pereira, Felipe Anchieta e Silva, Augusto César Azevedo Silva, Lysia Catarina Silva Cunha, Jaldyr de Jesus Gomes Varela Júnior, Pedro de Lima Neto, Auro Atsushi Takana, Thenner Silva Rodrigues, Marco Aurélio Suller Garcia
Publikováno v:
Journal of Materials Science. 57:8225-8240
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::23eeb2724a2b8f7be5f8c2f012000912
https://doi.org/10.1007/s10853-022-07193-w
https://doi.org/10.1007/s10853-022-07193-w
Autor:
Makson Rangel de Melo Rodrigues, Rayse Machado Ferreira, Fellipe dos Santos Pereira, Felipe Anchieta e Silva, Augusto César Azevedo Silva, Hector Aguilar Vitorino, Jaldyr de Jesus Gomes Varela Júnior, Auro Atsushi Tanaka, Marco Aurélio Suller Garcia, Thenner Silva Rodrigues
Publikováno v:
ChemCatChem. 14
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::00c7d334982f1530706b86b6465d4f79
https://doi.org/10.1002/cctc.202201376
https://doi.org/10.1002/cctc.202201376
Autor:
Makson Rangel de Melo Rodrigues, Rayse Machado Ferreira, Fellipe dos Santos Pereira, Felipe Anchieta e Silva, Augusto César Azevedo Silva, Hector Aguilar Vitorino, Jaldyr de Jesus Gomes Varela Júnior, Auro Atsushi Tanaka, Marco Aurélio Suller Garcia, Thenner Silva Rodrigues
Publikováno v:
ChemCatChem. 14
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::10eca276fbc0c3298201d4c17ff2a9ea
https://doi.org/10.1002/cctc.202200605
https://doi.org/10.1002/cctc.202200605
Autor:
Jaldyr de Jesus Gomes Varela, Augusto César Azevedo Silva, Adilson Luís Pereira Silva, Caio Vinícius Caetano, Francinaldo dos Santos Leite
Publikováno v:
Orbital: The Electronic Journal of Chemistry, Vol 13, Iss 3, Pp 212-218 (2021)
In this work, we explored the energy landscape and the effect of increasing the amount of Ag atoms over the segregation of Cu atoms in bimetallic clusters with compositions Cu3Agm (), using a genetic algorithm coupled with the Gupta potential to dete
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::23d0fdac7f5858e025463546516a3670
https://doi.org/10.17807/orbital.v13i3.1536
https://doi.org/10.17807/orbital.v13i3.1536
Publikováno v:
Computational and Theoretical Chemistry. 1215:113836
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::0da7446eff43b4df1a77bffb8c545e07
https://doi.org/10.1016/j.comptc.2022.113836
https://doi.org/10.1016/j.comptc.2022.113836
Autor:
Caleb Nathan Navis, Adilson Luís Pereira Silva, Augusto César Azevedo Silva, Jaldyr de Jesus Gomes Varela Júnior
Publikováno v:
Journal of Nanoparticle Research. 23
A theoretical study on the interactions between X12Y12 nanocages (Al12N12, Al12P12, B12N12, and B12P12) and putrescine molecule (Put) is presented, using density functional theory (DFT) B3LYP/6-31+G(d) methodology. Structural, energetic, and electron
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::b7ba90be284c96539f0a08ef222402d5
https://doi.org/10.1007/s11051-021-05211-7
https://doi.org/10.1007/s11051-021-05211-7