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Polycarbonitrile: an evaluation using electronic structure methods to analyze their respective electronic and structural stability

This work presents an investigation of the structural stability of polycarbonitrile with different monomeric units to confirm the pertinence of not using a cis-trans geometry, but an intermediate structure. Thermochemical and non-linear optic properties are calculated and compared to different confo...

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Detalles Bibliográficos
Autores principales:	Faccin, Pedro, Custodio, Rogerio, Morais, Guilherme de
Formato:	Online
Lenguaje:	portugués
Publicado:	Universidade Estadual de Campinas 2019
Materias:	Polycarbonitrile Electronic structure Structural stability
Acceso en línea:	https://econtents.sbu.unicamp.br/eventos/index.php/pibic/article/view/2997
Etiquetas:	Agregar Etiqueta Sin Etiquetas, Sea el primero en etiquetar este registro!

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