Selective absorption of H2S and CO2 by azole based protic ionic liquids: A combined density functional theory and molecular dynamics study

Author:

Shaikh Abdul Rajjak,Posada-Pérez SergioORCID,Brotons-Rufes Artur,Pajski Jason J.,Vajiha ,Kumar Gulshan,Mateen Ayesha,Poater Albert,Solà Miquel,Chawla Mohit,Cavallo Luigi

Publisher

Elsevier BV

Subject

Materials Chemistry,Physical and Theoretical Chemistry,Spectroscopy,Condensed Matter Physics,Atomic and Molecular Physics, and Optics,Electronic, Optical and Magnetic Materials

Reference70 articles.

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3. Energy Performance of Stripper Configurations for CO2 Capture by Aqueous Amines;Oyenekan;Ind. Eng. Chem. Res.,2006

4. Mechanism of CO2 fixation by Ir–X Bonds (X = OH, OR, N, C);Vummaleti;Eur. J. Inorg. Chem.,2015

5. How easy is CO2 fixation by M-C bond containing complexes (M = Cu, Ni Co, Rh, Ir)?;Vummaleti;Org. Chem. Front.,2016

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