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Molecular Dynamics Simulations of the Solubility of H2S and CO2 in Water

We have performed molecular dynamics simulations atconstant temperature and pressure to calculate the solubility of carbondioxide (CO2) and hydrogen sulfide (H2S) in water. The solubilityof gases in water is important in several technological problems, inparticular in the petroleum industry. The cal...

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Publicado no:Journal of the Mexican Chemical Society
Main Authors: José Alejandre, Roberto López Rendón
Formato: Artigo
Idioma:Inglês
Publicado em: Sociedad Química de México 2008
Assuntos:
Acesso em linha:https://www.redalyc.org/articulo.oa?id=47552113
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