Search Results - Machado, Daniel Francisco Scalabrini

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  1. 1
    Deciphering Stereoselectivity in Hurd‐Claisen Rearrangements: A Comprehensive Study of Electrostatic Interactions from Shubin's Energy Decomposition Analysis

    Deciphering Stereoselectivity in Hurd‐Claisen Rearrangements: A Comprehensive Study of Electrostatic Interactions from Shubin's Energy Decomposition Analysis by Oliveira, Ana Gabriela Coelho, Barbosa, Mateus Rodrigues, Matias, Pedro Henrique Ferreira, Silva, Charlley Anchieta Lourenço, Machado, Daniel Francisco Scalabrini, Lira Machado, Ângelo Henrique, Benedito de Oliveira, Heibbe Cristhian

    Published in Chemphyschem
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  2. 2
    Non-covalent interactions and their impact on the complexation thermodynamics of noble gases with methanol

    Non-covalent interactions and their impact on the complexation thermodynamics of noble gases with methanol by Vieira, Lúcio Renan, de Brito, Sandro Francisco, Barbosa, Mateus Rodrigues, Lopes, Thiago Oliveira, Machado, Daniel Francisco Scalabrini, de Oliveira, Heibbe Cristhian B

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  3. 3
    Unprecedented E-stereoselectivity on the sigmatropic Hurd-Claisen rearrangement of Morita-Baylis-Hillman adducts: a joint experimental-theoretical study

    Unprecedented E-stereoselectivity on the sigmatropic Hurd-Claisen rearrangement of Morita-Baylis-Hillman adducts: a joint experimental-theoretical study by Silva, Vinicius Sobral, Tolentino, Terezinha Alves, Rodrigues, Tiago Costa Alves Fontoura, Santos, Fernanda Ferrari Martins, Machado, Daniel Francisco Scalabrini, Silva, Wender Alves, Oliveira, Heibbe Cristhian Benedito de, Machado, Angelo Henrique Lira

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  4. 4
    Cover Feature: Deciphering Stereoselectivity in Hurd‐Claisen Rearrangements: A Comprehensive Study of Electrostatic Interactions from Shubin's Energy Decomposition Analysis (ChemPhysChem 19/2024)

    Cover Feature: Deciphering Stereoselectivity in Hurd‐Claisen Rearrangements: A Comprehensive Study of Electrostatic Interactions from Shubin's Energy Decomposition Analysis (ChemPh... by Oliveira, Ana Gabriela Coelho, Barbosa, Mateus Rodrigues, Matias, Pedro Henrique Ferreira, Silva, Charlley Anchieta Lourenço, Machado, Daniel Francisco Scalabrini, Lira Machado, Ângelo Henrique, Benedito de Oliveira, Heibbe Cristhian

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  5. 5
    Explicit Aqueous Solvation Treatment of Epinephrine from Car–Parrinello Molecular Dynamics: Effect of Hydrogen Bonding on the Electronic Absorption Spectrum

    Explicit Aqueous Solvation Treatment of Epinephrine from Car–Parrinello Molecular Dynamics: Effect of Hydrogen Bonding on the Electronic Absorption Spectrum by Neto, Arsênio P. V, Machado, Daniel F. Scalabrini, Lopes, Thiago O, Camargo, Ademir J, de Oliveira, Heibbe C. B

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  6. 6
    Strong Solvent Effects on the Nonlinear Optical Properties of Z and E isomers from Azo-Enaminone Derivatives

    Strong Solvent Effects on the Nonlinear Optical Properties of Z and E isomers from Azo-Enaminone Derivatives by Machado, Daniel Francisco Scalabrini, Lopes, Thiago O, Lima, Igo Torres, da Silva Filho, Demetrio Antonio, de Oliveira, Heibbe Cristhian Benedito

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  7. 7
    Bond Ellipticity Alternation: An Accurate Descriptor of the Non-Linear Optical Properties of π-Conjugated Chromophores

    Bond Ellipticity Alternation: An Accurate Descriptor of the Non-Linear Optical Properties of π-Conjugated Chromophores by Lopes, Thiago O, Machado, Daniel Francisco Scalabrini, Risko, Chad, Bredas, Jean-Luc, de Oliveira, Heibbe Cristhian Benedito

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