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@InProceedings{EuclidesBarr:2017:SoToRe,
               author = "Euclides, Henrique O. and Barreto, Patr{\'{\i}}cia Regina 
                         Pereira",
          affiliation = "{} and {Instituto Nacional de Pesquisas Espaciais (INPE)}",
                title = "APUAMA: a software tool for reaction rate calculations",
            booktitle = "Anais...",
                 year = "2017",
               editor = "Cerqueira, Christopher Shneider and B{\"u}rger, Eduardo Escobar 
                         and Yassuda, Irineu dos Santos and Rodrigues, Italo Pinto and 
                         Lima, Jeanne Samara dos Santos and Oliveira, M{\^o}nica Elizabeth 
                         Rocha de and Ten{\'o}rio, Pl{\'{\i}}nio Ivo Gama",
         organization = "Workshop em Engenharia e Tecnologias Espaciais, 8. (WETE)",
            publisher = "Instituto Nacional de Pesquisas Espaciais (INPE)",
              address = "S{\~a}o Jos{\'e} dos Campos",
             keywords = "APUAMA code, Rate constant, Quantum chemistry, Rovibrational 
                         Levels, Thermodynamic properties.",
             abstract = "APUAMA is a free software designed to determine the reaction rate 
                         and thermodynamic properties of chemical species of a reagent 
                         system. With data from electronic structure calculations, the 
                         APUAMA determine the rate constant with tunneling correction, such 
                         as Wigner, Eckart and small curvature, and also, include the 
                         rovibrational level of diatomic molecules. The results are 
                         presented in the form of Arrhenius form, for the reaction rate, 
                         and the thermodynamic properties are written down in the 
                         polynomial form. The word APUAMA means fast in Tupi-Guarani 
                         Brazilian language, then the code calculates the reaction rate on 
                         a simple, intuitive graphic interface, the form fast and 
                         practical. As program output, there are several text files with 
                         tabulated information for rate constant, rovibrational levels, 
                         energy barriers and enthalpy of reaction, Arrhenius coefficient, 
                         and also, the option to the User save all graphics in BMP 
                         format.",
  conference-location = "S{\~a}o Jos{\'e} dos Campos",
      conference-year = "9-10 ago. 2017",
                 issn = "2177-3114",
             language = "en",
         organisation = "Instituto Nacional de Pesquisas Espaciais (INPE)",
                  ibi = "8JMKD3MGPDW34R/3QAN3UL",
                  url = "http://urlib.net/rep/8JMKD3MGPDW34R/3QAN3UL",
           targetfile = "1_[ARTIGO] Henrique Euclides.pdf",
                 type = "Ci{\^e}ncia e Tecnologia de Materiais e Controle",
        urlaccessdate = "27 nov. 2020"
}


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