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- W2056297467 endingPage "044707" @default.
- W2056297467 startingPage "044707" @default.
- W2056297467 abstract "Porous coordination polymers (PCPs) with soft frameworks show a gate phenomenon consisting of an abrupt structural transition induced by adsorption of guest molecules. To understand the dependence of the gating behavior on the host framework structure, we conduct grand canonical Monte Carlo simulations and a free-energy analysis of a simplified model of a stacked-layer PCP. The interlayer width of the rigid layers composing the simplified model can be changed by guest adsorption and by varying the initial interlayer width h0, which is controlled by the length of pillars between the layers. We introduce three types of gating behavior, one-step gating, filling and gating, and double gating, which depend on three parameters: the initial interlayer width h0; the interaction parameter ɛss, which determines the host–guest framework interaction as well as the inter-framework interaction; and the elastic modulus of the framework, which depends on the stiffness of the pillars. We show that the one-step gating and the filling and gating behaviors depend strongly on h0 rather than on ɛss, and thus a transformation from filling and gating to double gating can be achieved by reducing the stiffness of the host framework. This study should be a guideline for controlling the gating pressure of PCPs by modifying their chemical components." @default.
- W2056297467 created "2016-06-24" @default.
- W2056297467 creator A5041343252 @default.
- W2056297467 creator A5046532946 @default.
- W2056297467 creator A5052665380 @default.
- W2056297467 creator A5073018625 @default.
- W2056297467 date "2014-01-28" @default.
- W2056297467 modified "2023-09-27" @default.
- W2056297467 title "Dependence of adsorption-induced structural transition on framework structure of porous coordination polymers" @default.
- W2056297467 cites W1970400486 @default.
- W2056297467 cites W1970674718 @default.
- W2056297467 cites W1970993202 @default.
- W2056297467 cites W1971020125 @default.
- W2056297467 cites W1987003761 @default.
- W2056297467 cites W1987652875 @default.
- W2056297467 cites W1996060474 @default.
- W2056297467 cites W1999937609 @default.
- W2056297467 cites W2001896723 @default.
- W2056297467 cites W2002880500 @default.
- W2056297467 cites W2005281107 @default.
- W2056297467 cites W2006975471 @default.
- W2056297467 cites W2007157592 @default.
- W2056297467 cites W2009046788 @default.
- W2056297467 cites W2009626022 @default.
- W2056297467 cites W2016378930 @default.
- W2056297467 cites W2016539884 @default.
- W2056297467 cites W2019293828 @default.
- W2056297467 cites W2019410105 @default.
- W2056297467 cites W2021487825 @default.
- W2056297467 cites W2021537121 @default.
- W2056297467 cites W2021767761 @default.
- W2056297467 cites W2024085431 @default.
- W2056297467 cites W2027254520 @default.
- W2056297467 cites W2028888408 @default.
- W2056297467 cites W2036807682 @default.
- W2056297467 cites W2037007806 @default.
- W2056297467 cites W2039253153 @default.
- W2056297467 cites W2045528289 @default.
- W2056297467 cites W2049906942 @default.
- W2056297467 cites W2050311951 @default.
- W2056297467 cites W2052989960 @default.
- W2056297467 cites W2053416118 @default.
- W2056297467 cites W2056127514 @default.
- W2056297467 cites W2060548465 @default.
- W2056297467 cites W2062195075 @default.
- W2056297467 cites W2062858999 @default.
- W2056297467 cites W2065465350 @default.
- W2056297467 cites W2069064313 @default.
- W2056297467 cites W2069548705 @default.
- W2056297467 cites W2072436367 @default.
- W2056297467 cites W2075797658 @default.
- W2056297467 cites W2084294134 @default.
- W2056297467 cites W2084507685 @default.
- W2056297467 cites W2088827401 @default.
- W2056297467 cites W2089199584 @default.
- W2056297467 cites W2092197672 @default.
- W2056297467 cites W2094392172 @default.
- W2056297467 cites W2100716186 @default.
- W2056297467 cites W2102457549 @default.
- W2056297467 cites W2123874510 @default.
- W2056297467 cites W2128115939 @default.
- W2056297467 cites W2133084791 @default.
- W2056297467 cites W2135506280 @default.
- W2056297467 cites W2146365972 @default.
- W2056297467 cites W2154961463 @default.
- W2056297467 cites W2154989874 @default.
- W2056297467 cites W2156572180 @default.
- W2056297467 cites W2168725496 @default.
- W2056297467 cites W2171608545 @default.
- W2056297467 cites W2318044185 @default.
- W2056297467 cites W2319259686 @default.
- W2056297467 cites W2319685113 @default.
- W2056297467 cites W2320326990 @default.
- W2056297467 cites W2321176824 @default.
- W2056297467 cites W2324134232 @default.
- W2056297467 cites W2333975495 @default.
- W2056297467 cites W2334549288 @default.
- W2056297467 cites W3098776361 @default.
- W2056297467 cites W3102632445 @default.
- W2056297467 cites W3105513197 @default.
- W2056297467 cites W4229817723 @default.
- W2056297467 doi "https://doi.org/10.1063/1.4862735" @default.
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- W2056297467 hasPublicationYear "2014" @default.
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