Modeling the stabilizing effects in energetic materials of diphenyl-amine and curcumin

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  • Presentation type: Palestra
  • Track: Quantum Dynamics
  • Keywords: stabilizer;

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  • 1 Instituto Militar de Engenharia

Modeling the stabilizing effects in energetic materials of diphenyl-amine and curcumin

João Luís do Nascimento Mossri

Instituto Militar de Engenharia

Abstract

Estados de transição da difenilamina e da curcumina são obtidos utilizando otimizações com método DFT/B3LYP//6-31G(d) com Gaussian 09. Em seguida, são comparados com o intuito de se avaliar a curcumina como um estabilizante alternativo à difenilamina.

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