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  • Artigo de periodico

    Investigating the effects of oxygen doping on the structural and electronic properties of small lithium clusters using density functional theory, quantum Monte Carlo, and Hartree-Fock calculations (2023)

    Brito, Braulio Gabriel Alencar ; Hai, Guo-Qiang ; Cândido, Ladir

    Source: Chemical Physics Letters. Unidade: IFSC

    Subjects: TERMODINÂMICA, HIDROGÊNIO, MÉTODO DE MONTE CARLO

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      BRITO, Braulio Gabriel Alencar e HAI, Guo-Qiang e CÂNDIDO, Ladir. Investigating the effects of oxygen doping on the structural and electronic properties of small lithium clusters using density functional theory, quantum Monte Carlo, and Hartree-Fock calculations. Chemical Physics Letters, v. No 2023, p. 140856-1-140856-8, 2023Tradução . . Disponível em: https://doi.org/10.1016/j.cplett.2023.140856. Acesso em: 16 set. 2024.

    • APA

      Brito, B. G. A., Hai, G. -Q., & Cândido, L. (2023). Investigating the effects of oxygen doping on the structural and electronic properties of small lithium clusters using density functional theory, quantum Monte Carlo, and Hartree-Fock calculations. Chemical Physics Letters, No 2023, 140856-1-140856-8. doi:10.1016/j.cplett.2023.140856

    • NLM

      Brito BGA, Hai G-Q, Cândido L. Investigating the effects of oxygen doping on the structural and electronic properties of small lithium clusters using density functional theory, quantum Monte Carlo, and Hartree-Fock calculations [Internet]. Chemical Physics Letters. 2023 ; No 2023 140856-1-140856-8.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cplett.2023.140856

    • Vancouver

      Brito BGA, Hai G-Q, Cândido L. Investigating the effects of oxygen doping on the structural and electronic properties of small lithium clusters using density functional theory, quantum Monte Carlo, and Hartree-Fock calculations [Internet]. Chemical Physics Letters. 2023 ; No 2023 140856-1-140856-8.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cplett.2023.140856

  • Trabalho de evento-anais periodico

    A python-based approach for thermodynamic consistency tests of binary VLE data (2023)

    Cezareth, Pedro; Reis, Martina Costa

    Source: Computer Aided Chemical Engineering. Conference titles: Proceedings of the European Symposium on Computer Aided Process Engineering. Unidade: EP

    Subjects: TERMODINÂMICA, ALGORITMOS

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      CEZARETH, Pedro e REIS, Martina Costa. A python-based approach for thermodynamic consistency tests of binary VLE data. Computer Aided Chemical Engineering. Amsterdam: Escola Politécnica, Universidade de São Paulo. Disponível em: https://doi.org/10.1016/B978-0-443-15274-0.50004-4. Acesso em: 16 set. 2024. , 2023

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      Cezareth, P., & Reis, M. C. (2023). A python-based approach for thermodynamic consistency tests of binary VLE data. Computer Aided Chemical Engineering. Amsterdam: Escola Politécnica, Universidade de São Paulo. doi:10.1016/B978-0-443-15274-0.50004-4

    • NLM

      Cezareth P, Reis MC. A python-based approach for thermodynamic consistency tests of binary VLE data [Internet]. Computer Aided Chemical Engineering. 2023 ;52 19-24.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/B978-0-443-15274-0.50004-4

    • Vancouver

      Cezareth P, Reis MC. A python-based approach for thermodynamic consistency tests of binary VLE data [Internet]. Computer Aided Chemical Engineering. 2023 ;52 19-24.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/B978-0-443-15274-0.50004-4

  • Artigo de periodico

    Fixed-node diffusion Monte Carlo simulation of small ionized carbon clusters (2022)

    Brito, B. G. A.; Hai, Guo-Qiang ; Cândido, Ladir

    Source: Chemical Physics Letters. Unidade: IFSC

    Subjects: TERMODINÂMICA, HIDROGÊNIO, MÉTODO DE MONTE CARLO

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      BRITO, B. G. A. e HAI, Guo-Qiang e CÂNDIDO, Ladir. Fixed-node diffusion Monte Carlo simulation of small ionized carbon clusters. Chemical Physics Letters, v. 804, p. 139888-1-139888-7, 2022Tradução . . Disponível em: https://doi.org/10.1016/j.cplett.2022.139888. Acesso em: 16 set. 2024.

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      Brito, B. G. A., Hai, G. -Q., & Cândido, L. (2022). Fixed-node diffusion Monte Carlo simulation of small ionized carbon clusters. Chemical Physics Letters, 804, 139888-1-139888-7. doi:10.1016/j.cplett.2022.139888

    • NLM

      Brito BGA, Hai G-Q, Cândido L. Fixed-node diffusion Monte Carlo simulation of small ionized carbon clusters [Internet]. Chemical Physics Letters. 2022 ; 804 139888-1-139888-7.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cplett.2022.139888

    • Vancouver

      Brito BGA, Hai G-Q, Cândido L. Fixed-node diffusion Monte Carlo simulation of small ionized carbon clusters [Internet]. Chemical Physics Letters. 2022 ; 804 139888-1-139888-7.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cplett.2022.139888

  • Artigo de periodico

    On the force scheme influence on pseudopotential method coexistence curve (2022)

    Mapelli, Vinicius Pessoa; Czelusniak, Luiz Eduardo; Guzella, Matheus dos Santos; Cabezas Gómez, Luben

    Source: Physica A : statistical mechanics and its applications. Unidade: EESC

    Subjects: ESCOAMENTO MULTIFÁSICO, TERMODINÂMICA, ENGENHARIA MECÂNICA

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      MAPELLI, Vinicius Pessoa et al. On the force scheme influence on pseudopotential method coexistence curve. Physica A : statistical mechanics and its applications, v. 599, p. 1-12, 2022Tradução . . Disponível em: https://doi.org/10.1016/j.physa.2022.127411. Acesso em: 16 set. 2024.

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      Mapelli, V. P., Czelusniak, L. E., Guzella, M. dos S., & Cabezas Gómez, L. (2022). On the force scheme influence on pseudopotential method coexistence curve. Physica A : statistical mechanics and its applications, 599, 1-12. doi:10.1016/j.physa.2022.127411

    • NLM

      Mapelli VP, Czelusniak LE, Guzella M dos S, Cabezas Gómez L. On the force scheme influence on pseudopotential method coexistence curve [Internet]. Physica A : statistical mechanics and its applications. 2022 ; 599 1-12.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.physa.2022.127411

    • Vancouver

      Mapelli VP, Czelusniak LE, Guzella M dos S, Cabezas Gómez L. On the force scheme influence on pseudopotential method coexistence curve [Internet]. Physica A : statistical mechanics and its applications. 2022 ; 599 1-12.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.physa.2022.127411

  • Artigo de periodico

    Path-integral Monte Carlo simulations on the thermodynamic properties of single-layer hexagonal boron nitride (2022)

    Brito, B. G. A.; Cândido, Ladir ; Rabelo, J. N. Teixeira; Hai, Guo-Qiang

    Source: Computational Condensed Matter. Unidade: IFSC

    Subjects: MÉTODO DE MONTE CARLO, TERMODINÂMICA

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    • ABNT

      BRITO, B. G. A. et al. Path-integral Monte Carlo simulations on the thermodynamic properties of single-layer hexagonal boron nitride. Computational Condensed Matter, v. 31, p. e00660-1-e00660-7, 2022Tradução . . Disponível em: https://doi.org/10.1016/j.cocom.2022.e00660. Acesso em: 16 set. 2024.

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      Brito, B. G. A., Cândido, L., Rabelo, J. N. T., & Hai, G. -Q. (2022). Path-integral Monte Carlo simulations on the thermodynamic properties of single-layer hexagonal boron nitride. Computational Condensed Matter, 31, e00660-1-e00660-7. doi:10.1016/j.cocom.2022.e00660

    • NLM

      Brito BGA, Cândido L, Rabelo JNT, Hai G-Q. Path-integral Monte Carlo simulations on the thermodynamic properties of single-layer hexagonal boron nitride [Internet]. Computational Condensed Matter. 2022 ; 31 e00660-1-e00660-7.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cocom.2022.e00660

    • Vancouver

      Brito BGA, Cândido L, Rabelo JNT, Hai G-Q. Path-integral Monte Carlo simulations on the thermodynamic properties of single-layer hexagonal boron nitride [Internet]. Computational Condensed Matter. 2022 ; 31 e00660-1-e00660-7.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cocom.2022.e00660

  • Artigo de periodico

    On the effect of elemental partitioning to secondary phases after solution and aging heat treatments in a Co-Ni-based superalloy (2022)

    Costa, Alessio M.S.; Oliveira, João Pedro ; Escobar, Julian D. ; Salvador, Camilo Augusto Fernandes ; Monteiro, M. J.; Poplawsky, Jonathan D. ; Nunes, Carlos Angelo ; Ramirez, Antonio Jose ; Tschiptschin, André Paulo

    Source: Materials Letters. Unidades: EP, IF

    Subjects: TRATAMENTO TÉRMICO, TERMODINÂMICA

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      COSTA, Alessio M.S. et al. On the effect of elemental partitioning to secondary phases after solution and aging heat treatments in a Co-Ni-based superalloy. Materials Letters, v. 309, p. 6 , 2022Tradução . . Disponível em: https://doi.org/10.1016/j.matlet.2021.131377. Acesso em: 16 set. 2024.

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      Costa, A. M. S., Oliveira, J. P., Escobar, J. D., Salvador, C. A. F., Monteiro, M. J., Poplawsky, J. D., et al. (2022). On the effect of elemental partitioning to secondary phases after solution and aging heat treatments in a Co-Ni-based superalloy. Materials Letters, 309, 6 . doi:10.1016/j.matlet.2021.131377

    • NLM

      Costa AMS, Oliveira JP, Escobar JD, Salvador CAF, Monteiro MJ, Poplawsky JD, Nunes CA, Ramirez AJ, Tschiptschin AP. On the effect of elemental partitioning to secondary phases after solution and aging heat treatments in a Co-Ni-based superalloy [Internet]. Materials Letters. 2022 ;309 6 .[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.matlet.2021.131377

    • Vancouver

      Costa AMS, Oliveira JP, Escobar JD, Salvador CAF, Monteiro MJ, Poplawsky JD, Nunes CA, Ramirez AJ, Tschiptschin AP. On the effect of elemental partitioning to secondary phases after solution and aging heat treatments in a Co-Ni-based superalloy [Internet]. Materials Letters. 2022 ;309 6 .[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.matlet.2021.131377

  • Artigo de periodico

    Exploring the interaction between lactoferrin and CdTe quantum dots: Energetic and molecular dynamic study (2022)

    Coelho, Yara Luiza ; Aguiar, Cínthia das Dores ; de Paula, Hauster Maximiler Campos ; Marques, Isabela Araujo; Rosa, Lívia Neves Santa ; Virtuoso, Luciano Sindra ; Duarte, Alfredo ; Pires, Ana Clarissa dos Santos Pires; Silva, Luis Henrique Mendes da

    Source: Journal of Molecular Liquids. Unidade: IQ

    Subjects: CINÉTICA, TERMODINÂMICA

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      COELHO, Yara Luiza et al. Exploring the interaction between lactoferrin and CdTe quantum dots: Energetic and molecular dynamic study. Journal of Molecular Liquids, v. 356, p. 1-9 art. 119005, 2022Tradução . . Disponível em: https://doi.org/10.1016/j.molliq.2022.119005. Acesso em: 16 set. 2024.

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      Coelho, Y. L., Aguiar, C. das D., de Paula, H. M. C., Marques, I. A., Rosa, L. N. S., Virtuoso, L. S., et al. (2022). Exploring the interaction between lactoferrin and CdTe quantum dots: Energetic and molecular dynamic study. Journal of Molecular Liquids, 356, 1-9 art. 119005. doi:10.1016/j.molliq.2022.119005

    • NLM

      Coelho YL, Aguiar C das D, de Paula HMC, Marques IA, Rosa LNS, Virtuoso LS, Duarte A, Pires AC dos SP, Silva LHM da. Exploring the interaction between lactoferrin and CdTe quantum dots: Energetic and molecular dynamic study [Internet]. Journal of Molecular Liquids. 2022 ; 356 1-9 art. 119005.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.molliq.2022.119005

    • Vancouver

      Coelho YL, Aguiar C das D, de Paula HMC, Marques IA, Rosa LNS, Virtuoso LS, Duarte A, Pires AC dos SP, Silva LHM da. Exploring the interaction between lactoferrin and CdTe quantum dots: Energetic and molecular dynamic study [Internet]. Journal of Molecular Liquids. 2022 ; 356 1-9 art. 119005.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.molliq.2022.119005

  • Artigo de periodico

    Quantum effects on the elastic properties of cubic boron nitride by path-integral Monte Carlo simulation (2022)

    Brito, B. G. A.; Hai, Guo-Qiang ; Cândido, L.

    Source: Computational Condensed Matter. Unidade: IFSC

    Subjects: MÉTODO DE MONTE CARLO, TERMODINÂMICA

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      BRITO, B. G. A. e HAI, Guo-Qiang e CÂNDIDO, L. Quantum effects on the elastic properties of cubic boron nitride by path-integral Monte Carlo simulation. Computational Condensed Matter, v. 33, p. e00759-1-e00759-7, 2022Tradução . . Disponível em: https://doi.org/10.1016/j.cocom.2022.e00759. Acesso em: 16 set. 2024.

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      Brito, B. G. A., Hai, G. -Q., & Cândido, L. (2022). Quantum effects on the elastic properties of cubic boron nitride by path-integral Monte Carlo simulation. Computational Condensed Matter, 33, e00759-1-e00759-7. doi:10.1016/j.cocom.2022.e00759

    • NLM

      Brito BGA, Hai G-Q, Cândido L. Quantum effects on the elastic properties of cubic boron nitride by path-integral Monte Carlo simulation [Internet]. Computational Condensed Matter. 2022 ; 33 e00759-1-e00759-7.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cocom.2022.e00759

    • Vancouver

      Brito BGA, Hai G-Q, Cândido L. Quantum effects on the elastic properties of cubic boron nitride by path-integral Monte Carlo simulation [Internet]. Computational Condensed Matter. 2022 ; 33 e00759-1-e00759-7.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cocom.2022.e00759

  • Artigo de periodico

    Thermodynamic stability in transition metal-containing dicationic diatomics: examining the case of CrO2+ (2021)

    Santos, Levi Gonçalves dos ; Franzreb, Klaus; Ornellas, Fernando Rei

    Source: Chemical Physics Letter. Unidade: IQ

    Subjects: TERMODINÂMICA, ESPECTROSCOPIA

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      SANTOS, Levi Gonçalves dos e FRANZREB, Klaus e ORNELLAS, Fernando Rei. Thermodynamic stability in transition metal-containing dicationic diatomics: examining the case of CrO2+. Chemical Physics Letter, v. 771, p. 1-5 art. 138525, 2021Tradução . . Disponível em: https://doi.org/10.1016/j.cplett.2021.138525. Acesso em: 16 set. 2024.

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      Santos, L. G. dos, Franzreb, K., & Ornellas, F. R. (2021). Thermodynamic stability in transition metal-containing dicationic diatomics: examining the case of CrO2+. Chemical Physics Letter, 771, 1-5 art. 138525. doi:10.1016/j.cplett.2021.138525

    • NLM

      Santos LG dos, Franzreb K, Ornellas FR. Thermodynamic stability in transition metal-containing dicationic diatomics: examining the case of CrO2+ [Internet]. Chemical Physics Letter. 2021 ; 771 1-5 art. 138525.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cplett.2021.138525

    • Vancouver

      Santos LG dos, Franzreb K, Ornellas FR. Thermodynamic stability in transition metal-containing dicationic diatomics: examining the case of CrO2+ [Internet]. Chemical Physics Letter. 2021 ; 771 1-5 art. 138525.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cplett.2021.138525

  • Artigo de periodico

    Multi criteria decision analysis for screening carbon dioxide conversion products (2021)

    Pacheco, Kelvin André ; Bresciani, Antonio Esio ; Alves, Rita Maria de Brito

    Source: Journal of CO2 Utilization. Unidade: EP

    Subjects: TERMODINÂMICA, DIÓXIDO DE CARBONO

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      PACHECO, Kelvin André e BRESCIANI, Antonio Esio e ALVES, Rita Maria de Brito. Multi criteria decision analysis for screening carbon dioxide conversion products. Journal of CO2 Utilization, v. 43, n. Ja 2021, p. 1-11, 2021Tradução . . Disponível em: https://doi.org/10.1016/j.jcou.2020.101391. Acesso em: 16 set. 2024.

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      Pacheco, K. A., Bresciani, A. E., & Alves, R. M. de B. (2021). Multi criteria decision analysis for screening carbon dioxide conversion products. Journal of CO2 Utilization, 43( Ja 2021), 1-11. doi:10.1016/j.jcou.2020.101391

    • NLM

      Pacheco KA, Bresciani AE, Alves RM de B. Multi criteria decision analysis for screening carbon dioxide conversion products [Internet]. Journal of CO2 Utilization. 2021 ; 43( Ja 2021): 1-11.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.jcou.2020.101391

    • Vancouver

      Pacheco KA, Bresciani AE, Alves RM de B. Multi criteria decision analysis for screening carbon dioxide conversion products [Internet]. Journal of CO2 Utilization. 2021 ; 43( Ja 2021): 1-11.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.jcou.2020.101391

  • Artigo de periodico

    Catalysts for glycerol hydrogenolysis to 1,3-propanediol: a review of chemical routes and market (2021)

    Ruy, Alisson Dias da Silva ; Alves, Rita Maria de Brito ; Hewer, Thiago Lewis Reis ; Pontes, Danilo de Aguiar ; Teixeira, Leonardo Sena Gomes ; Pontes, Luiz Antônio Magalhães

    Source: Catalysis Today. Unidade: EP

    Subjects: TERMODINÂMICA, CATALISADORES, BIODIESEL

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      RUY, Alisson Dias da Silva et al. Catalysts for glycerol hydrogenolysis to 1,3-propanediol: a review of chemical routes and market. Catalysis Today, v. 381, p. 243-253, 2021Tradução . . Disponível em: https://doi.org/10.1016/j.cattod.2020.06.035. Acesso em: 16 set. 2024.

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      Ruy, A. D. da S., Alves, R. M. de B., Hewer, T. L. R., Pontes, D. de A., Teixeira, L. S. G., & Pontes, L. A. M. (2021). Catalysts for glycerol hydrogenolysis to 1,3-propanediol: a review of chemical routes and market. Catalysis Today, 381, 243-253. doi:10.1016/j.cattod.2020.06.035

    • NLM

      Ruy AD da S, Alves RM de B, Hewer TLR, Pontes D de A, Teixeira LSG, Pontes LAM. Catalysts for glycerol hydrogenolysis to 1,3-propanediol: a review of chemical routes and market [Internet]. Catalysis Today. 2021 ; 381 243-253.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cattod.2020.06.035

    • Vancouver

      Ruy AD da S, Alves RM de B, Hewer TLR, Pontes D de A, Teixeira LSG, Pontes LAM. Catalysts for glycerol hydrogenolysis to 1,3-propanediol: a review of chemical routes and market [Internet]. Catalysis Today. 2021 ; 381 243-253.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cattod.2020.06.035

  • Artigo de periodico

    Deformation mechanisms of granulite-facies mafic shear zones from hole U1473A, Atlantis Bank, Southwest Indian Ridge (IODP Expedition 360) (2021)

    Taufner, Rhander ; Viegas, Gustavo ; Faleiros, Frederico Meira ; Castellan, Paulo; Silva, Raylline

    Source: Journal of Structural Geology. Unidade: IGC

    Subjects: TERMODINÂMICA, CISALHAMENTO, REOLOGIA

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      TAUFNER, Rhander et al. Deformation mechanisms of granulite-facies mafic shear zones from hole U1473A, Atlantis Bank, Southwest Indian Ridge (IODP Expedition 360). Journal of Structural Geology, n. , p. 104380-, 2021Tradução . . Disponível em: https://doi.org/10.1016/j.jsg.2021.104380. Acesso em: 16 set. 2024.

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      Taufner, R., Viegas, G., Faleiros, F. M., Castellan, P., & Silva, R. (2021). Deformation mechanisms of granulite-facies mafic shear zones from hole U1473A, Atlantis Bank, Southwest Indian Ridge (IODP Expedition 360). Journal of Structural Geology, ( ), 104380-. doi:10.1016/j.jsg.2021.104380

    • NLM

      Taufner R, Viegas G, Faleiros FM, Castellan P, Silva R. Deformation mechanisms of granulite-facies mafic shear zones from hole U1473A, Atlantis Bank, Southwest Indian Ridge (IODP Expedition 360) [Internet]. Journal of Structural Geology. 2021 ;( ): 104380-.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.jsg.2021.104380

    • Vancouver

      Taufner R, Viegas G, Faleiros FM, Castellan P, Silva R. Deformation mechanisms of granulite-facies mafic shear zones from hole U1473A, Atlantis Bank, Southwest Indian Ridge (IODP Expedition 360) [Internet]. Journal of Structural Geology. 2021 ;( ): 104380-.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.jsg.2021.104380

  • Artigo de periodico

    Thermodynamic stability and spectroscopic properties of alkaline earth monobromides (2020)

    Melo, Gabriel Fernando de ; Ornellas, Fernando Rei

    Source: Computational and Theoretical Chemistry. Unidade: IQ

    Subjects: TERMODINÂMICA, ÍONS, ESPECTROSCOPIA

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      MELO, Gabriel Fernando de e ORNELLAS, Fernando Rei. Thermodynamic stability and spectroscopic properties of alkaline earth monobromides. Computational and Theoretical Chemistry, v. 1178, p. 1-8 art. 112792, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.comptc.2020.112792. Acesso em: 16 set. 2024.

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      Melo, G. F. de, & Ornellas, F. R. (2020). Thermodynamic stability and spectroscopic properties of alkaline earth monobromides. Computational and Theoretical Chemistry, 1178, 1-8 art. 112792. doi:10.1016/j.comptc.2020.112792

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      Melo GF de, Ornellas FR. Thermodynamic stability and spectroscopic properties of alkaline earth monobromides [Internet]. Computational and Theoretical Chemistry. 2020 ; 1178 1-8 art. 112792.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.comptc.2020.112792

    • Vancouver

      Melo GF de, Ornellas FR. Thermodynamic stability and spectroscopic properties of alkaline earth monobromides [Internet]. Computational and Theoretical Chemistry. 2020 ; 1178 1-8 art. 112792.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.comptc.2020.112792

  • Trabalho de evento-anais periodico

    CO2-based acetic acid production assessment (2020)

    Pacheco, Kelvin André ; Bresciani, Antonio Esio ; Nascimento, Cláudio Augusto Oller do ; Alves, Rita Maria de Brito

    Source: Computer Aided Chemical Engineering. Conference titles: European Symposium on Computer Aided Process Engineering. Unidade: EP

    Subjects: TERMODINÂMICA, DIÓXIDO DE CARBONO

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      PACHECO, Kelvin André et al. CO2-based acetic acid production assessment. Computer Aided Chemical Engineering. Amsterdam: Elsevier. Disponível em: https://doi.org/10.1016/B978-0-12-823377-1.50172-5. Acesso em: 16 set. 2024. , 2020

    • APA

      Pacheco, K. A., Bresciani, A. E., Nascimento, C. A. O. do, & Alves, R. M. de B. (2020). CO2-based acetic acid production assessment. Computer Aided Chemical Engineering. Amsterdam: Elsevier. doi:10.1016/B978-0-12-823377-1.50172-5

    • NLM

      Pacheco KA, Bresciani AE, Nascimento CAO do, Alves RM de B. CO2-based acetic acid production assessment [Internet]. Computer Aided Chemical Engineering. 2020 ; 48 1027-1032.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/B978-0-12-823377-1.50172-5

    • Vancouver

      Pacheco KA, Bresciani AE, Nascimento CAO do, Alves RM de B. CO2-based acetic acid production assessment [Internet]. Computer Aided Chemical Engineering. 2020 ; 48 1027-1032.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/B978-0-12-823377-1.50172-5

  • Artigo de periodico

    A quantum Monte Carlo study of the structural and electronic properties of small boron clusters Bn (n = 1, …,13) (2020)

    Moreira, E. M. Isaac; Brito, B. G. A.; Hai, Guo-Qiang ; Cândido, Ladir

    Source: Chemical Physics Letters. Unidade: IFSC

    Subjects: TERMODINÂMICA, HIDROGÊNIO, MÉTODO DE MONTE CARLO

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      MOREIRA, E. M. Isaac et al. A quantum Monte Carlo study of the structural and electronic properties of small boron clusters Bn (n = 1, …,13). Chemical Physics Letters, v. 754, p. 137636-1-137636-7, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.cplett.2020.137636. Acesso em: 16 set. 2024.

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      Moreira, E. M. I., Brito, B. G. A., Hai, G. -Q., & Cândido, L. (2020). A quantum Monte Carlo study of the structural and electronic properties of small boron clusters Bn (n = 1, …,13). Chemical Physics Letters, 754, 137636-1-137636-7. doi:10.1016/j.cplett.2020.137636

    • NLM

      Moreira EMI, Brito BGA, Hai G-Q, Cândido L. A quantum Monte Carlo study of the structural and electronic properties of small boron clusters Bn (n = 1, …,13) [Internet]. Chemical Physics Letters. 2020 ; 754 137636-1-137636-7.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cplett.2020.137636

    • Vancouver

      Moreira EMI, Brito BGA, Hai G-Q, Cândido L. A quantum Monte Carlo study of the structural and electronic properties of small boron clusters Bn (n = 1, …,13) [Internet]. Chemical Physics Letters. 2020 ; 754 137636-1-137636-7.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.cplett.2020.137636

  • Artigo de periodico

    Quantum effects on elastic constants of diamond by path-integral Monte Carlo simulations (2020)

    Brito, B. G. A.; Hai, Guo-Qiang ; Cândido, Ladir

    Source: Computational Materials Science. Unidade: IFSC

    Subjects: TERMODINÂMICA, HIDROGÊNIO, MÉTODO DE MONTE CARLO

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      BRITO, B. G. A. e HAI, Guo-Qiang e CÂNDIDO, Ladir. Quantum effects on elastic constants of diamond by path-integral Monte Carlo simulations. Computational Materials Science, v. Fe 2020, p. 109387-109387-6, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.commatsci.2019.109387. Acesso em: 16 set. 2024.

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      Brito, B. G. A., Hai, G. -Q., & Cândido, L. (2020). Quantum effects on elastic constants of diamond by path-integral Monte Carlo simulations. Computational Materials Science, Fe 2020, 109387-109387-6. doi:10.1016/j.commatsci.2019.109387

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      Brito BGA, Hai G-Q, Cândido L. Quantum effects on elastic constants of diamond by path-integral Monte Carlo simulations [Internet]. Computational Materials Science. 2020 ; Fe 2020 109387-109387-6.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.commatsci.2019.109387

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      Brito BGA, Hai G-Q, Cândido L. Quantum effects on elastic constants of diamond by path-integral Monte Carlo simulations [Internet]. Computational Materials Science. 2020 ; Fe 2020 109387-109387-6.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.commatsci.2019.109387

  • Artigo de periodico

    Liquid Bi-Pb and Bi-Li alloys: Mining thermodynamic properties from ab-initio molecular dynamics calculations using thermodynamic models (2019)

    Dorini, T. T; Eleno, Luiz Tadeu Fernandes

    Source: Calphad-computer coupling of phase diagrams and thermochemistry. Unidade: EEL

    Subjects: TERMODINÂMICA, LÍTIO

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      DORINI, T. T e ELENO, Luiz Tadeu Fernandes. Liquid Bi-Pb and Bi-Li alloys: Mining thermodynamic properties from ab-initio molecular dynamics calculations using thermodynamic models. Calphad-computer coupling of phase diagrams and thermochemistry, v. 67, p. 101687-, 2019Tradução . . Disponível em: https://doi.org/10.1016/j.calphad.2019.101687. Acesso em: 16 set. 2024.

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      Dorini, T. T., & Eleno, L. T. F. (2019). Liquid Bi-Pb and Bi-Li alloys: Mining thermodynamic properties from ab-initio molecular dynamics calculations using thermodynamic models. Calphad-computer coupling of phase diagrams and thermochemistry, 67, 101687-. doi:10.1016/j.calphad.2019.101687

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      Dorini TT, Eleno LTF. Liquid Bi-Pb and Bi-Li alloys: Mining thermodynamic properties from ab-initio molecular dynamics calculations using thermodynamic models [Internet]. Calphad-computer coupling of phase diagrams and thermochemistry. 2019 ;67 101687-.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.calphad.2019.101687

    • Vancouver

      Dorini TT, Eleno LTF. Liquid Bi-Pb and Bi-Li alloys: Mining thermodynamic properties from ab-initio molecular dynamics calculations using thermodynamic models [Internet]. Calphad-computer coupling of phase diagrams and thermochemistry. 2019 ;67 101687-.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.calphad.2019.101687

  • Artigo de periodico

    Majority vote model with ancillary noise in complex networks (2019)

    Encinas Riveros, Jesus Mauricio; Hanshuang Chen; Oliveira, Marcelo M. de; Santos, Carlos Eduardo Fiore dos

    Source: Physica A: Statistical Mechanics and its Applications. Unidade: IF

    Subjects: MECÂNICA ESTATÍSTICA, TERMODINÂMICA, DINÂMICA ESTOCÁSTICA

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      ENCINAS RIVEROS, Jesus Mauricio et al. Majority vote model with ancillary noise in complex networks. Physica A: Statistical Mechanics and its Applications, v. 516, n. 15, p. 563-570, 2019Tradução . . Disponível em: https://doi.org/10.1016/j.physa.2018.10.055. Acesso em: 16 set. 2024.

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      Encinas Riveros, J. M., Hanshuang Chen,, Oliveira, M. M. de, & Santos, C. E. F. dos. (2019). Majority vote model with ancillary noise in complex networks. Physica A: Statistical Mechanics and its Applications, 516( 15), 563-570. doi:10.1016/j.physa.2018.10.055

    • NLM

      Encinas Riveros JM, Hanshuang Chen, Oliveira MM de, Santos CEF dos. Majority vote model with ancillary noise in complex networks [Internet]. Physica A: Statistical Mechanics and its Applications. 2019 ; 516( 15): 563-570.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.physa.2018.10.055

    • Vancouver

      Encinas Riveros JM, Hanshuang Chen, Oliveira MM de, Santos CEF dos. Majority vote model with ancillary noise in complex networks [Internet]. Physica A: Statistical Mechanics and its Applications. 2019 ; 516( 15): 563-570.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.physa.2018.10.055

  • Artigo de periodico

    Kinematics, nature of deformation and tectonic setting of the Taxaquara Shear Zone, a major transpressional zone of the Ribeira Belt (SE Brazil) (2019)

    Ribeiro, Bruno Vieira ; Faleiros, Frederico Meira ; Campanha, Ginaldo Ademar da Cruz ; Lagoeiro, Leonardo ; Weinberg, R. F.; Hunter, N. J. R.

    Source: Tectonophysics. Unidade: IGC

    Subjects: TERMODINÂMICA, CISALHAMENTO

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      RIBEIRO, Bruno Vieira et al. Kinematics, nature of deformation and tectonic setting of the Taxaquara Shear Zone, a major transpressional zone of the Ribeira Belt (SE Brazil). Tectonophysics, v. 751, n. , p. 83-108, 2019Tradução . . Disponível em: https://doi.org/10.1016/j.tecto.2018.12.025. Acesso em: 16 set. 2024.

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      Ribeiro, B. V., Faleiros, F. M., Campanha, G. A. da C., Lagoeiro, L., Weinberg, R. F., & Hunter, N. J. R. (2019). Kinematics, nature of deformation and tectonic setting of the Taxaquara Shear Zone, a major transpressional zone of the Ribeira Belt (SE Brazil). Tectonophysics, 751( ), 83-108. doi:10.1016/j.tecto.2018.12.025

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      Ribeiro BV, Faleiros FM, Campanha GA da C, Lagoeiro L, Weinberg RF, Hunter NJR. Kinematics, nature of deformation and tectonic setting of the Taxaquara Shear Zone, a major transpressional zone of the Ribeira Belt (SE Brazil) [Internet]. Tectonophysics. 2019 ; 751( ): 83-108.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.tecto.2018.12.025

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      Ribeiro BV, Faleiros FM, Campanha GA da C, Lagoeiro L, Weinberg RF, Hunter NJR. Kinematics, nature of deformation and tectonic setting of the Taxaquara Shear Zone, a major transpressional zone of the Ribeira Belt (SE Brazil) [Internet]. Tectonophysics. 2019 ; 751( ): 83-108.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.tecto.2018.12.025

  • Artigo de periodico

    Kinetic and thermodynamic compensation study of the hydration of faba beans (Vicia faba L.) (2019)

    Garvín, A; Augusto, Pedro Esteves Duarte; Ibarz, R; Ibarz, A

    Source: Food Research International. Unidade: ESALQ

    Subjects: FEIJÃO, CINÉTICA, HIDRATAÇÃO, TERMODINÂMICA

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      GARVÍN, A et al. Kinetic and thermodynamic compensation study of the hydration of faba beans (Vicia faba L.). Food Research International, v. 119, p. 390-397, 2019Tradução . . Disponível em: https://doi.org/10.1016/j.foodres.2019.02.002. Acesso em: 16 set. 2024.

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      Garvín, A., Augusto, P. E. D., Ibarz, R., & Ibarz, A. (2019). Kinetic and thermodynamic compensation study of the hydration of faba beans (Vicia faba L.). Food Research International, 119, 390-397. doi:10.1016/j.foodres.2019.02.002

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      Garvín A, Augusto PED, Ibarz R, Ibarz A. Kinetic and thermodynamic compensation study of the hydration of faba beans (Vicia faba L.) [Internet]. Food Research International. 2019 ; 119 390-397.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.foodres.2019.02.002

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      Garvín A, Augusto PED, Ibarz R, Ibarz A. Kinetic and thermodynamic compensation study of the hydration of faba beans (Vicia faba L.) [Internet]. Food Research International. 2019 ; 119 390-397.[citado 2024 set. 16 ] Available from: https://doi.org/10.1016/j.foodres.2019.02.002

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