The quantum-size effects on the first dehydrogenation of CH4 on 3d TMn (TM = Fe, Co, Ni, Cu where n = 4 - 15) clusters: DFT combined with data mining (2022)
- Authors:
- USP affiliated authors: SILVA, JUAREZ LOPES FERREIRA DA - IQSC ; MORAIS, FELIPE ORLANDO - IFSC ; SOUSA, PRISCILLA FELÍCIO - IQSC ; ANDRIANI, KARLA FURTADO - IQSC
- Unidades: IQSC; IFSC
- Subjects: METANO; CATALISADORES; MINERAÇÃO DE DADOS
- Keywords: Methane; Dehydrogenation; DFT; Data mining; Quantum-size effects
- Agências de fomento:
- Language: Inglês
- Imprenta:
- Publisher: Sociedade Brasileira de Química - SBQ
- Publisher place: São Paulo
- Date published: 2022
- Source:
- Título: Anais
- Conference titles: Reunião Anual da Sociedade Brasileira de Química - RASBQ
-
ABNT
SOUSA, Priscilla Felício et al. The quantum-size effects on the first dehydrogenation of CH4 on 3d TMn (TM = Fe, Co, Ni, Cu where n = 4 - 15) clusters: DFT combined with data mining. 2022, Anais.. São Paulo: Sociedade Brasileira de Química - SBQ, 2022. Disponível em: https://www.eventweb.com.br/45rasbq/specific-files/manuscripts/45rasbq/1173_1647817321.pdf. Acesso em: 02 out. 2024. -
APA
Sousa, P. F., Andriani, K. F., Morais, F. O., & Silva, J. L. F. da. (2022). The quantum-size effects on the first dehydrogenation of CH4 on 3d TMn (TM = Fe, Co, Ni, Cu where n = 4 - 15) clusters: DFT combined with data mining. In Anais. São Paulo: Sociedade Brasileira de Química - SBQ. Recuperado de https://www.eventweb.com.br/45rasbq/specific-files/manuscripts/45rasbq/1173_1647817321.pdf -
NLM
Sousa PF, Andriani KF, Morais FO, Silva JLF da. The quantum-size effects on the first dehydrogenation of CH4 on 3d TMn (TM = Fe, Co, Ni, Cu where n = 4 - 15) clusters: DFT combined with data mining [Internet]. Anais. 2022 ;[citado 2024 out. 02 ] Available from: https://www.eventweb.com.br/45rasbq/specific-files/manuscripts/45rasbq/1173_1647817321.pdf -
Vancouver
Sousa PF, Andriani KF, Morais FO, Silva JLF da. The quantum-size effects on the first dehydrogenation of CH4 on 3d TMn (TM = Fe, Co, Ni, Cu where n = 4 - 15) clusters: DFT combined with data mining [Internet]. Anais. 2022 ;[citado 2024 out. 02 ] Available from: https://www.eventweb.com.br/45rasbq/specific-files/manuscripts/45rasbq/1173_1647817321.pdf - Estudo ab initio das propriedades físicas e químicas de nanoligas de metais de transição (63 sistemas)
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