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Artigo de periodico
Ab initio investigation of topological phase transitions induced by pressure in trilayer van der Waals structures: the example of h-BN/SnTe/h-BN (2021)
Lima, Matheus P. ; Besse, Rafael ; Silva, Juarez Lopes Ferreira da
Source: Journal of Physics: Condensed Matter. Unidades: IQSC, IFSC
Subjects: FÍSICO-QUÍMICA, NANOPARTÍCULAS
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ABNT
LIMA, Matheus P. e BESSE, Rafael e SILVA, Juarez Lopes Ferreira da. Ab initio investigation of topological phase transitions induced by pressure in trilayer van der Waals structures: the example of h-BN/SnTe/h-BN. Journal of Physics: Condensed Matter, v. 33, n. Ja 2021, p. 025003-1 -025003-7, 2021Tradução . . Disponível em: https://doi.org/10.1088/1361-648X/abac8d. Acesso em: 23 maio 2024.
APA
Lima, M. P., Besse, R., & Silva, J. L. F. da. (2021). Ab initio investigation of topological phase transitions induced by pressure in trilayer van der Waals structures: the example of h-BN/SnTe/h-BN. Journal of Physics: Condensed Matter, 33( Ja 2021), 025003-1 -025003-7. doi:10.1088/1361-648X/abac8d
NLM
Lima MP, Besse R, Silva JLF da. Ab initio investigation of topological phase transitions induced by pressure in trilayer van der Waals structures: the example of h-BN/SnTe/h-BN [Internet]. Journal of Physics: Condensed Matter. 2021 ; 33( Ja 2021): 025003-1 -025003-7.[citado 2024 maio 23 ] Available from: https://doi.org/10.1088/1361-648X/abac8d
Vancouver
Lima MP, Besse R, Silva JLF da. Ab initio investigation of topological phase transitions induced by pressure in trilayer van der Waals structures: the example of h-BN/SnTe/h-BN [Internet]. Journal of Physics: Condensed Matter. 2021 ; 33( Ja 2021): 025003-1 -025003-7.[citado 2024 maio 23 ] Available from: https://doi.org/10.1088/1361-648X/abac8d
Artigo de periodico
Stacking order effects on the electronic and optical properties of graphene/transition metal dichalcogenide Van der Waals heterostructures (2021)
Silveira, Julian Francisco Rama Vieira ; Besse, Rafael ; Silva, Juarez Lopes Ferreira da
Source: ACS Applied Electronic Materials. Unidades: IQSC, IFSC
Subjects: METAIS, ELETRÔNICA QUÂNTICA
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ABNT
SILVEIRA, Julian Francisco Rama Vieira e BESSE, Rafael e SILVA, Juarez Lopes Ferreira da. Stacking order effects on the electronic and optical properties of graphene/transition metal dichalcogenide Van der Waals heterostructures. ACS Applied Electronic Materials, v. 3, n. 4, p. 1671-1680, 2021Tradução . . Disponível em: https://doi.org/10.1021/acsaelm.1c00009. Acesso em: 23 maio 2024.
APA
Silveira, J. F. R. V., Besse, R., & Silva, J. L. F. da. (2021). Stacking order effects on the electronic and optical properties of graphene/transition metal dichalcogenide Van der Waals heterostructures. ACS Applied Electronic Materials, 3( 4), 1671-1680. doi:10.1021/acsaelm.1c00009
NLM
Silveira JFRV, Besse R, Silva JLF da. Stacking order effects on the electronic and optical properties of graphene/transition metal dichalcogenide Van der Waals heterostructures [Internet]. ACS Applied Electronic Materials. 2021 ; 3( 4): 1671-1680.[citado 2024 maio 23 ] Available from: https://doi.org/10.1021/acsaelm.1c00009
Vancouver
Silveira JFRV, Besse R, Silva JLF da. Stacking order effects on the electronic and optical properties of graphene/transition metal dichalcogenide Van der Waals heterostructures [Internet]. ACS Applied Electronic Materials. 2021 ; 3( 4): 1671-1680.[citado 2024 maio 23 ] Available from: https://doi.org/10.1021/acsaelm.1c00009
Artigo de periodico
The role of the A-cations in the polymorphic stability and optoelectronic properties of lead-free ASnI3 perovskites (2021)
Ozório, Mailde da Silva ; Malladi, Srikanth ; Besse, Rafael ; Silva, Juarez Lopes Ferreira da
Source: Physical Chemistry Chemical Physics. Unidades: IQSC, IFSC
Subjects: PROPRIEDADES DOS MATERIAIS, CÉLULAS SOLARES
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ABNT
OZÓRIO, Mailde da Silva et al. The role of the A-cations in the polymorphic stability and optoelectronic properties of lead-free ASnI3 perovskites. Physical Chemistry Chemical Physics, v. 23, n. 3, p. 2286-2297, 2021Tradução . . Disponível em: https://doi.org/10.1039/D0CP06090A. Acesso em: 23 maio 2024.
APA
Ozório, M. da S., Malladi, S., Besse, R., & Silva, J. L. F. da. (2021). The role of the A-cations in the polymorphic stability and optoelectronic properties of lead-free ASnI3 perovskites. Physical Chemistry Chemical Physics, 23( 3), 2286-2297. doi:10.1039/D0CP06090A
NLM
Ozório M da S, Malladi S, Besse R, Silva JLF da. The role of the A-cations in the polymorphic stability and optoelectronic properties of lead-free ASnI3 perovskites [Internet]. Physical Chemistry Chemical Physics. 2021 ; 23( 3): 2286-2297.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/D0CP06090A
Vancouver
Ozório M da S, Malladi S, Besse R, Silva JLF da. The role of the A-cations in the polymorphic stability and optoelectronic properties of lead-free ASnI3 perovskites [Internet]. Physical Chemistry Chemical Physics. 2021 ; 23( 3): 2286-2297.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/D0CP06090A
Artigo de periodico
Ab initio screening of Pt-based transition-metal nanoalloys using descriptors derived from the adsorption and activation of CO2† (2021)
Mendes, Paulo de Carvalho Dias ; Verga, Lucas Garcia ; Silva, Juarez Lopes Ferreira da
Source: Physical Chemistry Chemical Physics. Unidade: IQSC
Subjects: METAIS, FÍSICO-QUÍMICA, ADSORÇÃO
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ABNT
MENDES, Paulo de Carvalho Dias e VERGA, Lucas Garcia e SILVA, Juarez Lopes Ferreira da. Ab initio screening of Pt-based transition-metal nanoalloys using descriptors derived from the adsorption and activation of CO2†. Physical Chemistry Chemical Physics, v. 23, p. 6029-6041, 2021Tradução . . Disponível em: https://doi.org/10.1039/d1cp00570g. Acesso em: 23 maio 2024.
APA
Mendes, P. de C. D., Verga, L. G., & Silva, J. L. F. da. (2021). Ab initio screening of Pt-based transition-metal nanoalloys using descriptors derived from the adsorption and activation of CO2†. Physical Chemistry Chemical Physics, 23, 6029-6041. doi:10.1039/d1cp00570g
NLM
Mendes P de CD, Verga LG, Silva JLF da. Ab initio screening of Pt-based transition-metal nanoalloys using descriptors derived from the adsorption and activation of CO2† [Internet]. Physical Chemistry Chemical Physics. 2021 ; 23 6029-6041.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/d1cp00570g
Vancouver
Mendes P de CD, Verga LG, Silva JLF da. Ab initio screening of Pt-based transition-metal nanoalloys using descriptors derived from the adsorption and activation of CO2† [Internet]. Physical Chemistry Chemical Physics. 2021 ; 23 6029-6041.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/d1cp00570g
Artigo de periodico
Correlation-based framework for extraction of insights from quantum chemistry databases: Applications for nanoclusters (2021)
Mucelini, Johnatan ; Quiles, Marcos Gonçalves ; Prati, Ronaldo Cristiano ; Silva, Juarez Lopes Ferreira da
Source: Journal of Chemical Information and Modeling. Unidade: IQSC
Subjects: QUÍMICA QUÂNTICA, MINERAÇÃO DE DADOS, FRAMEWORKS
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ABNT
MUCELINI, Johnatan et al. Correlation-based framework for extraction of insights from quantum chemistry databases: Applications for nanoclusters. Journal of Chemical Information and Modeling, v. 61, p. 1125-1135, 2021Tradução . . Disponível em: https://doi.org/10.1021/acs.jcim.0c01267. Acesso em: 23 maio 2024.
APA
Mucelini, J., Quiles, M. G., Prati, R. C., & Silva, J. L. F. da. (2021). Correlation-based framework for extraction of insights from quantum chemistry databases: Applications for nanoclusters. Journal of Chemical Information and Modeling, 61, 1125-1135. doi:10.1021/acs.jcim.0c01267
NLM
Mucelini J, Quiles MG, Prati RC, Silva JLF da. Correlation-based framework for extraction of insights from quantum chemistry databases: Applications for nanoclusters [Internet]. Journal of Chemical Information and Modeling. 2021 ; 61 1125-1135.[citado 2024 maio 23 ] Available from: https://doi.org/10.1021/acs.jcim.0c01267
Vancouver
Mucelini J, Quiles MG, Prati RC, Silva JLF da. Correlation-based framework for extraction of insights from quantum chemistry databases: Applications for nanoclusters [Internet]. Journal of Chemical Information and Modeling. 2021 ; 61 1125-1135.[citado 2024 maio 23 ] Available from: https://doi.org/10.1021/acs.jcim.0c01267
Artigo de periodico
First-principles insights into the role of edges in the binding mechanisms of Au4 clusters on MoSe2 nanoflakes (2021)
Caturello, Naidel Antonio Moreira dos Santos ; Besse, Rafael ; Silveira, Julian Francisco Rama Vieira ; Lima, Matheus P ; Silva, Juarez Lopes Ferreira da
Source: Physica E: low-dimensional systems and nanostructures. Unidades: IQSC, FFCLRP, IFSC
Subjects: OURO, CLUSTERS
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ABNT
CATURELLO, Naidel Antonio Moreira dos Santos et al. First-principles insights into the role of edges in the binding mechanisms of Au4 clusters on MoSe2 nanoflakes. Physica E: low-dimensional systems and nanostructures, v. 126, p. 114472-1-114472-9, 2021Tradução . . Disponível em: https://doi.org/10.1016/j.physe.2020.114472. Acesso em: 23 maio 2024.
APA
Caturello, N. A. M. dos S., Besse, R., Silveira, J. F. R. V., Lima, M. P., & Silva, J. L. F. da. (2021). First-principles insights into the role of edges in the binding mechanisms of Au4 clusters on MoSe2 nanoflakes. Physica E: low-dimensional systems and nanostructures, 126, 114472-1-114472-9. doi:10.1016/j.physe.2020.114472
NLM
Caturello NAM dos S, Besse R, Silveira JFRV, Lima MP, Silva JLF da. First-principles insights into the role of edges in the binding mechanisms of Au4 clusters on MoSe2 nanoflakes [Internet]. Physica E: low-dimensional systems and nanostructures. 2021 ; 126 114472-1-114472-9.[citado 2024 maio 23 ] Available from: https://doi.org/10.1016/j.physe.2020.114472
Vancouver
Caturello NAM dos S, Besse R, Silveira JFRV, Lima MP, Silva JLF da. First-principles insights into the role of edges in the binding mechanisms of Au4 clusters on MoSe2 nanoflakes [Internet]. Physica E: low-dimensional systems and nanostructures. 2021 ; 126 114472-1-114472-9.[citado 2024 maio 23 ] Available from: https://doi.org/10.1016/j.physe.2020.114472
Artigo de periodico
A hybrid-DFT investigation of the Ce oxidation state upon adsorption of F, Na, Ni, Pd and Pt on the (CeO2)6 cluster (2020)
Ozório, Mailde da Silva ; Andriani, Karla Furtado ; Silva, Juarez Lopes Ferreira da
Source: Physical Chemistry Chemical Physics - PCCP. Unidade: IQSC
Assunto: CLUSTERS
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ABNT
OZÓRIO, Mailde da Silva e ANDRIANI, Karla Furtado e SILVA, Juarez Lopes Ferreira da. A hybrid-DFT investigation of the Ce oxidation state upon adsorption of F, Na, Ni, Pd and Pt on the (CeO2)6 cluster. Physical Chemistry Chemical Physics - PCCP, v. 22, p. 14099-14108, 2020Tradução . . Disponível em: https://doi.org/10.1039/C9CP07005B. Acesso em: 23 maio 2024.
APA
Ozório, M. da S., Andriani, K. F., & Silva, J. L. F. da. (2020). A hybrid-DFT investigation of the Ce oxidation state upon adsorption of F, Na, Ni, Pd and Pt on the (CeO2)6 cluster. Physical Chemistry Chemical Physics - PCCP, 22, 14099-14108. doi:10.1039/C9CP07005B
NLM
Ozório M da S, Andriani KF, Silva JLF da. A hybrid-DFT investigation of the Ce oxidation state upon adsorption of F, Na, Ni, Pd and Pt on the (CeO2)6 cluster [Internet]. Physical Chemistry Chemical Physics - PCCP. 2020 ; 22 14099-14108.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/C9CP07005B
Vancouver
Ozório M da S, Andriani KF, Silva JLF da. A hybrid-DFT investigation of the Ce oxidation state upon adsorption of F, Na, Ni, Pd and Pt on the (CeO2)6 cluster [Internet]. Physical Chemistry Chemical Physics - PCCP. 2020 ; 22 14099-14108.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/C9CP07005B
Artigo de periodico
Ab initio investigation of the formation mechanism of nano-interfaces between 3d-late transition-metals and ZrO2 nanoclusters (2020)
Besse, Larissa Zibordi ; Verga, Lucas Garcia ; Restrepo, Vivianne k ; Silva, Juarez Lopes Ferreira da
Source: Physical Chemistry Chemical Physics - PCCP. Unidade: IQSC
Assunto: CLUSTERS
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ABNT
BESSE, Larissa Zibordi et al. Ab initio investigation of the formation mechanism of nano-interfaces between 3d-late transition-metals and ZrO2 nanoclusters. Physical Chemistry Chemical Physics - PCCP, v. 22, p. 8067-8076 Mar 2020, 2020Tradução . . Disponível em: https://doi.org/10.1039/D0CP00584C. Acesso em: 23 maio 2024.
APA
Besse, L. Z., Verga, L. G., Restrepo, V. k, & Silva, J. L. F. da. (2020). Ab initio investigation of the formation mechanism of nano-interfaces between 3d-late transition-metals and ZrO2 nanoclusters. Physical Chemistry Chemical Physics - PCCP, 22, 8067-8076 Mar 2020. doi:10.1039/D0CP00584C
NLM
Besse LZ, Verga LG, Restrepo V k, Silva JLF da. Ab initio investigation of the formation mechanism of nano-interfaces between 3d-late transition-metals and ZrO2 nanoclusters [Internet]. Physical Chemistry Chemical Physics - PCCP. 2020 ;22 8067-8076 Mar 2020.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/D0CP00584C
Vancouver
Besse LZ, Verga LG, Restrepo V k, Silva JLF da. Ab initio investigation of the formation mechanism of nano-interfaces between 3d-late transition-metals and ZrO2 nanoclusters [Internet]. Physical Chemistry Chemical Physics - PCCP. 2020 ;22 8067-8076 Mar 2020.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/D0CP00584C
Artigo de periodico
Ab initio insights into the formation mechanisms of 55-atom Pt- based core−Shell Nanoalloys (2020)
Mendes, Paulo de Carvalho Dias ; Justo, Stella Granatto ; Mucelini, Johnatan ; Soares, Marinalva Dias ; Batista, Krys Elly de Araújo ; Quiles, Marcos Gonçalves ; Piotrowski, Maurício Jeomar ; Silva, Juarez Lopes Ferreira da
Source: The Journal of Physical Chemistry C. Unidade: IQSC
Subjects: CATALISADORES, NANOPARTÍCULAS
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ABNT
MENDES, Paulo de Carvalho Dias et al. Ab initio insights into the formation mechanisms of 55-atom Pt- based core−Shell Nanoalloys. The Journal of Physical Chemistry C, v. 124, n. 1, p. 1158-1164, 2020Tradução . . Disponível em: https://doi.org/10.1021/acs.jpcc.9b09561. Acesso em: 23 maio 2024.
APA
Mendes, P. de C. D., Justo, S. G., Mucelini, J., Soares, M. D., Batista, K. E. de A., Quiles, M. G., et al. (2020). Ab initio insights into the formation mechanisms of 55-atom Pt- based core−Shell Nanoalloys. The Journal of Physical Chemistry C, 124( 1), 1158-1164. doi:10.1021/acs.jpcc.9b09561
NLM
Mendes P de CD, Justo SG, Mucelini J, Soares MD, Batista KE de A, Quiles MG, Piotrowski MJ, Silva JLF da. Ab initio insights into the formation mechanisms of 55-atom Pt- based core−Shell Nanoalloys [Internet]. The Journal of Physical Chemistry C. 2020 ; 124( 1): 1158-1164.[citado 2024 maio 23 ] Available from: https://doi.org/10.1021/acs.jpcc.9b09561
Vancouver
Mendes P de CD, Justo SG, Mucelini J, Soares MD, Batista KE de A, Quiles MG, Piotrowski MJ, Silva JLF da. Ab initio insights into the formation mechanisms of 55-atom Pt- based core−Shell Nanoalloys [Internet]. The Journal of Physical Chemistry C. 2020 ; 124( 1): 1158-1164.[citado 2024 maio 23 ] Available from: https://doi.org/10.1021/acs.jpcc.9b09561
Artigo de periodico
Unveiling the adsorption properties of 3d, 4d, and 5d metal adatoms on the MoS2 monolayer: A DFT-D3 investigation (2020)
Amaral, Rafael Costa ; Forhat, Ahmad; Caturello, Naidel A. M. S ; Silva, Juarez Lopes Ferreira da
Source: Surface Science. Unidade: IQSC
Assunto: ADSORÇÃO
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ABNT
AMARAL, Rafael Costa et al. Unveiling the adsorption properties of 3d, 4d, and 5d metal adatoms on the MoS2 monolayer: A DFT-D3 investigation. Surface Science, v. No2020, p. 121700, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.susc.2020.121700. Acesso em: 23 maio 2024.
APA
Amaral, R. C., Forhat, A., Caturello, N. A. M. S., & Silva, J. L. F. da. (2020). Unveiling the adsorption properties of 3d, 4d, and 5d metal adatoms on the MoS2 monolayer: A DFT-D3 investigation. Surface Science, No2020, 121700. doi:10.1016/j.susc.2020.121700
NLM
Amaral RC, Forhat A, Caturello NAMS, Silva JLF da. Unveiling the adsorption properties of 3d, 4d, and 5d metal adatoms on the MoS2 monolayer: A DFT-D3 investigation [Internet]. Surface Science. 2020 ; No2020 121700.[citado 2024 maio 23 ] Available from: https://doi.org/10.1016/j.susc.2020.121700
Vancouver
Amaral RC, Forhat A, Caturello NAMS, Silva JLF da. Unveiling the adsorption properties of 3d, 4d, and 5d metal adatoms on the MoS2 monolayer: A DFT-D3 investigation [Internet]. Surface Science. 2020 ; No2020 121700.[citado 2024 maio 23 ] Available from: https://doi.org/10.1016/j.susc.2020.121700
Artigo de periodico
Optical and dielectric properties of lead perovskite and iodoplumbate complexes:: an ab initio study (2020)
Srikanth, Malladi ; Ozório, Mailde da Silva ; Silva, Juarez Lopes Ferreira da
Source: Physical Chemistry Chemical Physics - PCCP. Unidade: IQSC
Assunto: CÉLULAS SOLARES
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ABNT
SRIKANTH, Malladi e OZÓRIO, Mailde da Silva e SILVA, Juarez Lopes Ferreira da. Optical and dielectric properties of lead perovskite and iodoplumbate complexes:: an ab initio study. Physical Chemistry Chemical Physics - PCCP, v. 22, p. 18423--18434, 2020Tradução . . Disponível em: https://doi.org/10.1039/D0CP03512B. Acesso em: 23 maio 2024.
APA
Srikanth, M., Ozório, M. da S., & Silva, J. L. F. da. (2020). Optical and dielectric properties of lead perovskite and iodoplumbate complexes:: an ab initio study. Physical Chemistry Chemical Physics - PCCP, 22, 18423--18434. doi:10.1039/D0CP03512B
NLM
Srikanth M, Ozório M da S, Silva JLF da. Optical and dielectric properties of lead perovskite and iodoplumbate complexes:: an ab initio study [Internet]. Physical Chemistry Chemical Physics - PCCP. 2020 ;22 18423--18434.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/D0CP03512B
Vancouver
Srikanth M, Ozório M da S, Silva JLF da. Optical and dielectric properties of lead perovskite and iodoplumbate complexes:: an ab initio study [Internet]. Physical Chemistry Chemical Physics - PCCP. 2020 ;22 18423--18434.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/D0CP03512B
Artigo de periodico
Mixed Halide Lead-free Double Perovskite Alloys for Band Gap Engineering (2020)
Silveira, Julian Francisco Rama Vieira ; Silva, Juarez Lopes Ferreira da
Source: ACS Applied Energy Materials. Unidade: IQSC
Assunto: CÉLULAS SOLARES
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ABNT
SILVEIRA, Julian Francisco Rama Vieira e SILVA, Juarez Lopes Ferreira da. Mixed Halide Lead-free Double Perovskite Alloys for Band Gap Engineering. ACS Applied Energy Materials, v. 3, n. 8, p. 7364–7371, 2020Tradução . . Disponível em: https://doi.org/10.1021/acsaem.0c00739. Acesso em: 23 maio 2024.
APA
Silveira, J. F. R. V., & Silva, J. L. F. da. (2020). Mixed Halide Lead-free Double Perovskite Alloys for Band Gap Engineering. ACS Applied Energy Materials, 3( 8), 7364–7371. doi:10.1021/acsaem.0c00739
NLM
Silveira JFRV, Silva JLF da. Mixed Halide Lead-free Double Perovskite Alloys for Band Gap Engineering [Internet]. ACS Applied Energy Materials. 2020 ;3( 8): 7364–7371.[citado 2024 maio 23 ] Available from: https://doi.org/10.1021/acsaem.0c00739
Vancouver
Silveira JFRV, Silva JLF da. Mixed Halide Lead-free Double Perovskite Alloys for Band Gap Engineering [Internet]. ACS Applied Energy Materials. 2020 ;3( 8): 7364–7371.[citado 2024 maio 23 ] Available from: https://doi.org/10.1021/acsaem.0c00739
Artigo de periodico
Interfacial Structures in Ionic Liquid-Based Ternary Electrolytes for Lithium-Metal Batteries: A Molecular Dynamics Study (2020)
Lourenço, Tuanan da Costa ; Ebadi, Mahsa ; Brandell, Daniel ; Silva, Juarez Lopes Ferreira da ; Costa, Luciano Tavares da
Source: The Journal of Physical Chemistry B. Unidade: IQSC
Subjects: BATERIAS ELÉTRICAS, METAIS, LÍTIO, ELETRÓLITOS
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ABNT
LOURENÇO, Tuanan da Costa et al. Interfacial Structures in Ionic Liquid-Based Ternary Electrolytes for Lithium-Metal Batteries: A Molecular Dynamics Study. The Journal of Physical Chemistry B, v. 124, p. 9648−9657, 2020Tradução . . Disponível em: https://doi.org/10.1021/acs.jpcb.0c06500. Acesso em: 23 maio 2024.
APA
Lourenço, T. da C., Ebadi, M., Brandell, D., Silva, J. L. F. da, & Costa, L. T. da. (2020). Interfacial Structures in Ionic Liquid-Based Ternary Electrolytes for Lithium-Metal Batteries: A Molecular Dynamics Study. The Journal of Physical Chemistry B, 124, 9648−9657. doi:10.1021/acs.jpcb.0c06500
NLM
Lourenço T da C, Ebadi M, Brandell D, Silva JLF da, Costa LT da. Interfacial Structures in Ionic Liquid-Based Ternary Electrolytes for Lithium-Metal Batteries: A Molecular Dynamics Study [Internet]. The Journal of Physical Chemistry B. 2020 ; 124 9648−9657.[citado 2024 maio 23 ] Available from: https://doi.org/10.1021/acs.jpcb.0c06500
Vancouver
Lourenço T da C, Ebadi M, Brandell D, Silva JLF da, Costa LT da. Interfacial Structures in Ionic Liquid-Based Ternary Electrolytes for Lithium-Metal Batteries: A Molecular Dynamics Study [Internet]. The Journal of Physical Chemistry B. 2020 ; 124 9648−9657.[citado 2024 maio 23 ] Available from: https://doi.org/10.1021/acs.jpcb.0c06500
Artigo de periodico
A hybrid density functional theory investigation of the (CeO2)6 clusters in the cationic, neutral, and anionic states (2020)
Ozório, Mailde da Silva ; Silva, Augusto Cesar Huppes da ; Silva, Juarez Lopes Ferreira da
Source: Journal of Cluster Science. Unidade: IQSC
Subjects: QUÍMICA QUÂNTICA, CLUSTERS
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ABNT
OZÓRIO, Mailde da Silva e SILVA, Augusto Cesar Huppes da e SILVA, Juarez Lopes Ferreira da. A hybrid density functional theory investigation of the (CeO2)6 clusters in the cationic, neutral, and anionic states. Journal of Cluster Science, v. 31, p. 1213–1220, 2020Tradução . . Disponível em: https://doi.org/10.1007/s10876-019-01728-z. Acesso em: 23 maio 2024.
APA
Ozório, M. da S., Silva, A. C. H. da, & Silva, J. L. F. da. (2020). A hybrid density functional theory investigation of the (CeO2)6 clusters in the cationic, neutral, and anionic states. Journal of Cluster Science, 31, 1213–1220. doi:10.1007/s10876-019-01728-z
NLM
Ozório M da S, Silva ACH da, Silva JLF da. A hybrid density functional theory investigation of the (CeO2)6 clusters in the cationic, neutral, and anionic states [Internet]. Journal of Cluster Science. 2020 ; 31 1213–1220.[citado 2024 maio 23 ] Available from: https://doi.org/10.1007/s10876-019-01728-z
Vancouver
Ozório M da S, Silva ACH da, Silva JLF da. A hybrid density functional theory investigation of the (CeO2)6 clusters in the cationic, neutral, and anionic states [Internet]. Journal of Cluster Science. 2020 ; 31 1213–1220.[citado 2024 maio 23 ] Available from: https://doi.org/10.1007/s10876-019-01728-z
Artigo de periodico
Novel zero-dimensional lead-free bismuth based perovskites:: from synthesis to structural and optoelectronic characterization (2020)
Ozório, Mailde da Silva ; Oliveira, Willian X. C. ; Silveira, Julian Francisco Rama Vieira ; Nogueira, Ana Flávia ; Silva, Juarez Lopes Ferreira da
Source: Materials Advances. Unidade: IQSC
Assunto: QUÍMICA TEÓRICA
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ABNT
OZÓRIO, Mailde da Silva et al. Novel zero-dimensional lead-free bismuth based perovskites:: from synthesis to structural and optoelectronic characterization. Materials Advances, v. 1, p. 3439-3448, 2020Tradução . . Disponível em: https://doi.org/10.1039/d0ma00791a. Acesso em: 23 maio 2024.
APA
Ozório, M. da S., Oliveira, W. X. C., Silveira, J. F. R. V., Nogueira, A. F., & Silva, J. L. F. da. (2020). Novel zero-dimensional lead-free bismuth based perovskites:: from synthesis to structural and optoelectronic characterization. Materials Advances, 1, 3439-3448. doi:10.1039/d0ma00791a
NLM
Ozório M da S, Oliveira WXC, Silveira JFRV, Nogueira AF, Silva JLF da. Novel zero-dimensional lead-free bismuth based perovskites:: from synthesis to structural and optoelectronic characterization [Internet]. Materials Advances. 2020 ; 1 3439-3448.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/d0ma00791a
Vancouver
Ozório M da S, Oliveira WXC, Silveira JFRV, Nogueira AF, Silva JLF da. Novel zero-dimensional lead-free bismuth based perovskites:: from synthesis to structural and optoelectronic characterization [Internet]. Materials Advances. 2020 ; 1 3439-3448.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/d0ma00791a
Artigo de periodico
Ab initio insights into the stabilization and binding mechanisms of MoS2 nanoflakes supported on graphene (2020)
Caturello, Naidel A. M. S ; Silveira, Julian Francisco Rama Vieira ; Silva, Juarez Lopes Ferreira da
Source: Physical Chemistry Chemical Physics - PCCP. Unidade: IQSC
Assunto: FÍSICO-QUÍMICA
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ABNT
CATURELLO, Naidel A. M. S e SILVEIRA, Julian Francisco Rama Vieira e SILVA, Juarez Lopes Ferreira da. Ab initio insights into the stabilization and binding mechanisms of MoS2 nanoflakes supported on graphene. Physical Chemistry Chemical Physics - PCCP, v. 22, p. 26865--26875, 2020Tradução . . Disponível em: https://doi.org/10.1039/D0CP04573J. Acesso em: 23 maio 2024.
APA
Caturello, N. A. M. S., Silveira, J. F. R. V., & Silva, J. L. F. da. (2020). Ab initio insights into the stabilization and binding mechanisms of MoS2 nanoflakes supported on graphene. Physical Chemistry Chemical Physics - PCCP, 22, 26865--26875. doi:10.1039/D0CP04573J
NLM
Caturello NAMS, Silveira JFRV, Silva JLF da. Ab initio insights into the stabilization and binding mechanisms of MoS2 nanoflakes supported on graphene [Internet]. Physical Chemistry Chemical Physics - PCCP. 2020 ;22 26865--26875.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/D0CP04573J
Vancouver
Caturello NAMS, Silveira JFRV, Silva JLF da. Ab initio insights into the stabilization and binding mechanisms of MoS2 nanoflakes supported on graphene [Internet]. Physical Chemistry Chemical Physics - PCCP. 2020 ;22 26865--26875.[citado 2024 maio 23 ] Available from: https://doi.org/10.1039/D0CP04573J
Artigo de periodico
Insights into the nature of optically active defects of ZnO (2020)
Cabral, Luis; Richard, Victor Lopez; Silva, Juarez Lopes Ferreira da ; Marques, G.E.; Lima, Matheus P ; Onofre, Y. J; Teodoro, M. D; Godoy, M P F de
Source: Journal of Luminescence. Unidade: IQSC
Subjects: FOTOLUMINESCÊNCIA, FOTOCONDUTIVIDADE
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
CABRAL, Luis et al. Insights into the nature of optically active defects of ZnO. Journal of Luminescence, v. No 2020, p. 117536, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.jlumin.2020.117536. Acesso em: 23 maio 2024.
APA
Cabral, L., Richard, V. L., Silva, J. L. F. da, Marques, G. E., Lima, M. P., Onofre, Y. J., et al. (2020). Insights into the nature of optically active defects of ZnO. Journal of Luminescence, No 2020, 117536. doi:10.1016/j.jlumin.2020.117536
NLM
Cabral L, Richard VL, Silva JLF da, Marques GE, Lima MP, Onofre YJ, Teodoro MD, Godoy MPF de. Insights into the nature of optically active defects of ZnO [Internet]. Journal of Luminescence. 2020 ; No 2020 117536.[citado 2024 maio 23 ] Available from: https://doi.org/10.1016/j.jlumin.2020.117536
Vancouver
Cabral L, Richard VL, Silva JLF da, Marques GE, Lima MP, Onofre YJ, Teodoro MD, Godoy MPF de. Insights into the nature of optically active defects of ZnO [Internet]. Journal of Luminescence. 2020 ; No 2020 117536.[citado 2024 maio 23 ] Available from: https://doi.org/10.1016/j.jlumin.2020.117536
Artigo de periodico
Ab initio investigation of the role of charge transfer in the adsorption properties of H2, N2, O2, CO, NO, CO2, NO2, and CH4 on the van derWaals layered Sn3O4 semiconductor (2020)
Freire, Rafael L. H. ; Marcelo O. Orlandi ; Silva, Juarez Lopes Ferreira da
Source: Physical Review Materials. Unidade: IQSC
Subjects: FÍSICO-QUÍMICA, SEMICONDUTORES
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
FREIRE, Rafael L. H. e MARCELO O. ORLANDI, e SILVA, Juarez Lopes Ferreira da. Ab initio investigation of the role of charge transfer in the adsorption properties of H2, N2, O2, CO, NO, CO2, NO2, and CH4 on the van derWaals layered Sn3O4 semiconductor. Physical Review Materials, v. 4, n. 10, p. 104002, 2020Tradução . . Disponível em: https://doi.org/10.1103/PhysRevMaterials.4.104002. Acesso em: 23 maio 2024.
APA
Freire, R. L. H., Marcelo O. Orlandi,, & Silva, J. L. F. da. (2020). Ab initio investigation of the role of charge transfer in the adsorption properties of H2, N2, O2, CO, NO, CO2, NO2, and CH4 on the van derWaals layered Sn3O4 semiconductor. Physical Review Materials, 4( 10), 104002. doi:10.1103/PhysRevMaterials.4.104002
NLM
Freire RLH, Marcelo O. Orlandi, Silva JLF da. Ab initio investigation of the role of charge transfer in the adsorption properties of H2, N2, O2, CO, NO, CO2, NO2, and CH4 on the van derWaals layered Sn3O4 semiconductor [Internet]. Physical Review Materials. 2020 ; 4( 10): 104002.[citado 2024 maio 23 ] Available from: https://doi.org/10.1103/PhysRevMaterials.4.104002
Vancouver
Freire RLH, Marcelo O. Orlandi, Silva JLF da. Ab initio investigation of the role of charge transfer in the adsorption properties of H2, N2, O2, CO, NO, CO2, NO2, and CH4 on the van derWaals layered Sn3O4 semiconductor [Internet]. Physical Review Materials. 2020 ; 4( 10): 104002.[citado 2024 maio 23 ] Available from: https://doi.org/10.1103/PhysRevMaterials.4.104002
Artigo de periodico
Active electrochemical interfaces stabilized through self-organized potential oscillations (2020)
Nogueira, Jéssica Alves; Lopes, Pietro P; Markovic, Nenad M; Varela, Hamilton
Source: Electrochemistry Communications. Unidade: IQSC
Subjects: METANOL, ELETROCATÁLISE
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
NOGUEIRA, Jéssica Alves et al. Active electrochemical interfaces stabilized through self-organized potential oscillations. Electrochemistry Communications, v. 121 art. 106853, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.elecom.2020.106853. Acesso em: 23 maio 2024.
APA
Nogueira, J. A., Lopes, P. P., Markovic, N. M., & Varela, H. (2020). Active electrochemical interfaces stabilized through self-organized potential oscillations. Electrochemistry Communications, 121 art. 106853. doi:10.1016/j.elecom.2020.106853
NLM
Nogueira JA, Lopes PP, Markovic NM, Varela H. Active electrochemical interfaces stabilized through self-organized potential oscillations [Internet]. Electrochemistry Communications. 2020 ; 121 art. 106853[citado 2024 maio 23 ] Available from: https://doi.org/10.1016/j.elecom.2020.106853
Vancouver
Nogueira JA, Lopes PP, Markovic NM, Varela H. Active electrochemical interfaces stabilized through self-organized potential oscillations [Internet]. Electrochemistry Communications. 2020 ; 121 art. 106853[citado 2024 maio 23 ] Available from: https://doi.org/10.1016/j.elecom.2020.106853
Artigo de periodico
Methane dehydrogenation on 3d 13-atom transition-metal clusters: A density functional theory investigation combined with Spearman rank correlation analysis (2020)
Andriani, Karla Furtado ; Mucelini, Johnatan ; Silva, Juarez Lopes Ferreira da
Source: Fuel: The Science and Technology of Fuel and Energy. Unidade: IQSC
Subjects: CATALISADORES, METANOL, GÁS NATURAL, CÉLULAS A COMBUSTÍVEL
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ABNT
ANDRIANI, Karla Furtado e MUCELINI, Johnatan e SILVA, Juarez Lopes Ferreira da. Methane dehydrogenation on 3d 13-atom transition-metal clusters: A density functional theory investigation combined with Spearman rank correlation analysis. Fuel: The Science and Technology of Fuel and Energy, v. 275, p. 117790, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.fuel.2020.117790. Acesso em: 23 maio 2024.
APA
Andriani, K. F., Mucelini, J., & Silva, J. L. F. da. (2020). Methane dehydrogenation on 3d 13-atom transition-metal clusters: A density functional theory investigation combined with Spearman rank correlation analysis. Fuel: The Science and Technology of Fuel and Energy, 275, 117790. doi:10.1016/j.fuel.2020.117790
NLM
Andriani KF, Mucelini J, Silva JLF da. Methane dehydrogenation on 3d 13-atom transition-metal clusters: A density functional theory investigation combined with Spearman rank correlation analysis [Internet]. Fuel: The Science and Technology of Fuel and Energy. 2020 ; 275 117790.[citado 2024 maio 23 ] Available from: https://doi.org/10.1016/j.fuel.2020.117790
Vancouver
Andriani KF, Mucelini J, Silva JLF da. Methane dehydrogenation on 3d 13-atom transition-metal clusters: A density functional theory investigation combined with Spearman rank correlation analysis [Internet]. Fuel: The Science and Technology of Fuel and Energy. 2020 ; 275 117790.[citado 2024 maio 23 ] Available from: https://doi.org/10.1016/j.fuel.2020.117790

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