Literature DB >> 17668094

On the breathing effect of a metal-organic framework upon CO(2) adsorption: Monte Carlo compared to microcalorimetry experiments.

Naseem A Ramsahye1, Guillaume Maurin, Sandrine Bourrelly, Philip L Llewellyn, Thierry Loiseau, Christian Serre, Gérard Férey.   

Abstract

Grand Canonical Monte Carlo simulations have explained the breathing of a metal-organic framework upon CO(2) adsorption, first suggested by microcalorimetry.

Entities:  

Year:  2007        PMID： 17668094     DOI： 10.1039/b702986a

Source DB:  PubMed          Journal:  Chem Commun (Camb)        ISSN： 1359-7345            Impact factor:   6.222


  6 in total

1.  Modeling of adsorption of CO2 in the deformed pores of MIL-53(Al).

Authors:  Ege Dundar; Nicolas Chanut; Filip Formalik; Pascal Boulet; Philip L Llewellyn; Bogdan Kuchta
Journal:  J Mol Model       Date:  2017-03-02       Impact factor: 1.810

2.  Selection of a suitable ZIF-8/ionic liquid (IL) based composite for selective CO2 capture: the role of anions at the interface.

Authors:  Anoopa Thomas; Rafiq Ahamed; Muthuramalingam Prakash
Journal:  RSC Adv       Date:  2020-10-26       Impact factor: 4.036

Review 3.  A Review on Breathing Behaviors of Metal-Organic-Frameworks (MOFs) for Gas Adsorption.

Authors:  Mays Alhamami; Huu Doan; Chil-Hung Cheng
Journal:  Materials (Basel)       Date:  2014-04-21       Impact factor: 3.623

4.  Tailoring the separation properties of flexible metal-organic frameworks using mechanical pressure.

Authors:  Nicolas Chanut; Aziz Ghoufi; Marie-Vanessa Coulet; Sandrine Bourrelly; Bodgan Kuchta; Guillaume Maurin; Philip L Llewellyn
Journal:  Nat Commun       Date:  2020-03-05       Impact factor: 14.919

5.  Effect of axial molecules and linker length on CO2 adsorption and selectivity of CAU-8: a combined DFT and GCMC simulation study.

Authors:  Diem Thi-Xuan Dang; Hieu Trung Hoang; Tan Le Hoang Doan; Nam Thoai; Yoshiyuki Kawazoe; Duc Nguyen-Manh
Journal:  RSC Adv       Date:  2021-03-30       Impact factor: 3.361

6.  Discovery of Colossal Breathing-Caloric Effect under Low Applied Pressure in the Hybrid Organic-Inorganic MIL-53(Al) Material.

Authors:  Javier García-Ben; Jorge López-Beceiro; Ramon Artiaga; Jorge Salgado-Beceiro; Ignacio Delgado-Ferreiro; Yury V Kolen'ko; Socorro Castro-García; María Antonia Señarís-Rodríguez; Manuel Sánchez-Andújar; Juan Manuel Bermúdez-García
Journal:  Chem Mater       Date:  2022-03-30       Impact factor: 10.508
  6 in total

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