Please use this identifier to cite or link to this item:
http://repositorio.ufc.br/handle/riufc/54760| Type: | Artigo de Evento |
| Title: | Simulação molecular de adsorção de H2S em faujasitas |
| Authors: | Coelho, Juliana Amorim Gomes, Victor Aias Martins Lucena, Sebastião Mardônio Pereira de Azevedo, Diana Cristina Silva de |
| Keywords: | Sulfeto de hidrogênio;Catalisadores de zeólita;Faujasite zeólitas |
| Issue Date: | 2011 |
| Citation: | COELHO, Juliana Amorim; GOMES, Victor Aias Martins; LUCENA, Sebastião Mardônio Pereira de; AZEVEDO, Diana Cristina Silva de. Simulação molecular de adsorção de H2S em faujasitas. In: CONGRESSO BRASILEIRO DE PESQUISA E DESENVOLVIMENTO EM PETRÓLEO E GÁS, 06º., 09 a 13 out. 2011, Florianópolis, Santa Catarina, Brasil. Anais[…] Florianópolis, Santa Catarina, 2011. |
| Abstract: | Relevant experimental data of adsorption isotherms of H2S are scarce and very difficult. This make this system ideal for your study be conducted through the the techniques of Grand Canonical Monte Carlo (GCMC) simulations to obtain force field parameters that reproduce experimental data of adsorption of H2S in faujasite. Several models for the molecule of H2S in the literature were applied to the system H2S_FAU. The system using the Y molecular sieve impregnated with sodium ions (NaY) was modeled. From a new parameterization of the force field was able to reproduce experimental adsorption isotherms found in the literature. |
| URI: | http://www.repositorio.ufc.br/handle/riufc/54760 |
| Appears in Collections: | DEQ - Trabalhos apresentados em eventos |
Files in This Item:
| File | Description | Size | Format | |
|---|---|---|---|---|
| 2017_eve_jacoelho.pdf | 1,02 MB | Adobe PDF | View/Open |
Items in DSpace are protected by copyright, with all rights reserved, unless otherwise indicated.