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Gaussian basis sets by generator coordinate Hartree-Fock method to ab initio calculations of electron affinities of enolates

Fed Univ Para; CEAM; Universidade Estadual Paulista (Unesp); Universidade de São Paulo (USP) (Elsevier B.V., 2002-07-05)

The Generator Coordinate Hartree-Fock (GCHF) method is employed to generate uncontracted 15s and 18s11p gaussian basis sets for the H, C and O atoms, respectively. These basis sets are then contracted to 3s and 4s H atom ...

Gaussian basis sets by generator coordinate Hartree-Fock method to ab initio calculations of electron affinities of enolates

Fed Univ Para; CEAM; Universidade Estadual Paulista (Unesp); Universidade de São Paulo (USP) (Elsevier B.V., 2002-07-05)

Gaussian basis sets by generator coordinate Hartree-Fock method to ab initio calculations of electron affinities of enolates

Savedra, RML; Pinheiro, J. C.; Treu, O.; Kondo, R. T. (Elsevier B.V., 2014)

Curiosidades sobre a reação aldólica utilizada como etapa chave na síntese Brasileira dos ácidos pterídicos A e BCuriosities about the aldol reaction employed as a key step in the synthesis of pteridic acids A and B

Dias, Luiz C.; Salles Jr., Airton G. (Sociedade Brasileira de Química, 2010)

Substituent, Temperature and Solvent Effects on the Keto-Enol Equilibrium in β-Ketoamides: A Nuclear Magnetic Resonance Study

Laurella, Sergio Luis; González Sierra, Manuel; Furlong, Jorge Javier Pedro; Allegretti, Patricia Ercilia (2013)

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Gaussian basis sets by generator coordinate Hartree-Fock method to ab initio calculations of electron affinities of enolates

Gaussian basis sets by generator coordinate Hartree-Fock method to ab initio calculations of electron affinities of enolates

Gaussian basis sets by generator coordinate Hartree-Fock method to ab initio calculations of electron affinities of enolates

Curiosidades sobre a reação aldólica utilizada como etapa chave na síntese Brasileira dos ácidos pterídicos A e BCuriosities about the aldol reaction employed as a key step in the synthesis of pteridic acids A and B

Substituent, Temperature and Solvent Effects on the Keto-Enol Equilibrium in β-Ketoamides: A Nuclear Magnetic Resonance Study

Exploring azide-enolate cycloaddition in the synthesis of novel Rufinamide analogs

Síntesis, estabilización con metales de transición y caracterización del enol del o-metil benzaldehido

Cis hidroxilacion de dobles ligaduras de acetatos de enol de cetonas esteroidales

NMR and theoretical investigation of the keto-enol tautomerism in cyclohexane-1,3-diones

Keto-Enol Tautomerism in Passerini and Ugi Adducts

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Gaussian basis sets by generator coordinate Hartree-Fock method to ab initio calculations of electron affinities of enolates

Gaussian basis sets by generator coordinate Hartree-Fock method to ab initio calculations of electron affinities of enolates

Gaussian basis sets by generator coordinate Hartree-Fock method to ab initio calculations of electron affinities of enolates

Curiosidades sobre a reação aldólica utilizada como etapa chave na síntese Brasileira dos ácidos pterídicos A e BCuriosities about the aldol reaction employed as a key step in the synthesis of pteridic acids A and B

Substituent, Temperature and Solvent Effects on the Keto-Enol Equilibrium in β-Ketoamides: A Nuclear Magnetic Resonance Study

Exploring azide-enolate cycloaddition in the synthesis of novel Rufinamide analogs

Síntesis, estabilización con metales de transición y caracterización del enol del o-metil benzaldehido

Cis hidroxilacion de dobles ligaduras de acetatos de enol de cetonas esteroidales

NMR and theoretical investigation of the keto-enol tautomerism in cyclohexane-1,3-diones

Keto-Enol Tautomerism in Passerini and Ugi Adducts