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On the breathing effect of a metal-organic framework upon CO(2) adsorption: Monte Carlo compared to microcalorimetry experiments |
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| Authors: | Ramsahye Naseem A Maurin Guillaume Bourrelly Sandrine Llewellyn Philip L Loiseau Thierry Serre Christian Férey Gérard |
| Affiliation: | Institut C. Gerhardt, UMR 5253 CNRS UM2, ENSCM, Université Montpellier II, 34095 Montpellier cedex 05, France. |
| Abstract: | Grand Canonical Monte Carlo simulations have explained the breathing of a metal-organic framework upon CO(2) adsorption, first suggested by microcalorimetry. |
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