Matches in SemOpenAlex for { <https://semopenalex.org/work/W160233724> ?p ?o ?g. }
Showing items 1 to 96 of
96
with 100 items per page.
- W160233724 endingPage "551" @default.
- W160233724 startingPage "535" @default.
- W160233724 abstract "Abstract We review recent applications of jump models for diffusion in zeolites. We describe the results of a coarse-grained model of the interplay between zeolite anisotropy and disorder, finding that certain disorder patterns can change how anisotropy controls membrane permeation. We show the results of a lattice model for single-file diffusion in zeolite membranes, demonstrating how singlefile motion is manifested in anomalous mean-square displacements at short times, and in non-intensive Fickian self-diffusion coefficients at later times. We discuss a normal-mode analysis approach for treating framework flexibility for tight-fitting zeolite-guest systems, showing that simulations allowing for framework flexibility can converge is less CPU time than those that keep the framework rigid. We then explore models of the loading dependence of selfdiffusion in zeolites, with emphasis on benzene in NaX and NaY. We enumerate the decisions that need to be made when modeling such systems, and indicate the choices/approximations we have made for modeling benzene in NaX and NaY. We report kinetic Monte Carlo results for the loading dependence of benzene diffusion in NaX, which is found in reasonable agreement with NMR data, but in poor agreement with tracer ZLC results. We then speculate on the possibility of having a subcritical fluid adsorbed in a nanoporous material, and how such a thermodynamic state would impact diffusion in such a system. We close with a review of outstanding problems in modeling jump diffusion in zeolites." @default.
- W160233724 created "2016-06-24" @default.
- W160233724 creator A5075368706 @default.
- W160233724 date "2006-05-03" @default.
- W160233724 modified "2023-10-17" @default.
- W160233724 title "MODELING JUMP DIFFUSION IN ZEOLITES: II. APPLICATIONS" @default.
- W160233724 cites W1969233767 @default.
- W160233724 cites W1979571681 @default.
- W160233724 cites W1985623411 @default.
- W160233724 cites W1985885382 @default.
- W160233724 cites W2014831943 @default.
- W160233724 cites W2019162240 @default.
- W160233724 cites W2024521556 @default.
- W160233724 cites W2033178369 @default.
- W160233724 cites W2033813683 @default.
- W160233724 cites W2048666880 @default.
- W160233724 cites W2051419523 @default.
- W160233724 cites W2064116739 @default.
- W160233724 cites W2082423349 @default.
- W160233724 cites W2088874688 @default.
- W160233724 cites W2153919438 @default.
- W160233724 cites W2170744848 @default.
- W160233724 cites W2901519208 @default.
- W160233724 doi "https://doi.org/10.1007/1-4020-4382-1_24" @default.
- W160233724 hasPublicationYear "2006" @default.
- W160233724 type Work @default.
- W160233724 sameAs 160233724 @default.
- W160233724 citedByCount "3" @default.
- W160233724 countsByYear W1602337242014 @default.
- W160233724 crossrefType "book-chapter" @default.
- W160233724 hasAuthorship W160233724A5075368706 @default.
- W160233724 hasConcept C105795698 @default.
- W160233724 hasConcept C121332964 @default.
- W160233724 hasConcept C121864883 @default.
- W160233724 hasConcept C161790260 @default.
- W160233724 hasConcept C171250308 @default.
- W160233724 hasConcept C178790620 @default.
- W160233724 hasConcept C185592680 @default.
- W160233724 hasConcept C192562407 @default.
- W160233724 hasConcept C19499675 @default.
- W160233724 hasConcept C203504353 @default.
- W160233724 hasConcept C2777691172 @default.
- W160233724 hasConcept C2778077586 @default.
- W160233724 hasConcept C33923547 @default.
- W160233724 hasConcept C41625074 @default.
- W160233724 hasConcept C45786274 @default.
- W160233724 hasConcept C48940184 @default.
- W160233724 hasConcept C50670333 @default.
- W160233724 hasConcept C53403541 @default.
- W160233724 hasConcept C55493867 @default.
- W160233724 hasConcept C62520636 @default.
- W160233724 hasConcept C69357855 @default.
- W160233724 hasConcept C85725439 @default.
- W160233724 hasConcept C97355855 @default.
- W160233724 hasConceptScore W160233724C105795698 @default.
- W160233724 hasConceptScore W160233724C121332964 @default.
- W160233724 hasConceptScore W160233724C121864883 @default.
- W160233724 hasConceptScore W160233724C161790260 @default.
- W160233724 hasConceptScore W160233724C171250308 @default.
- W160233724 hasConceptScore W160233724C178790620 @default.
- W160233724 hasConceptScore W160233724C185592680 @default.
- W160233724 hasConceptScore W160233724C192562407 @default.
- W160233724 hasConceptScore W160233724C19499675 @default.
- W160233724 hasConceptScore W160233724C203504353 @default.
- W160233724 hasConceptScore W160233724C2777691172 @default.
- W160233724 hasConceptScore W160233724C2778077586 @default.
- W160233724 hasConceptScore W160233724C33923547 @default.
- W160233724 hasConceptScore W160233724C41625074 @default.
- W160233724 hasConceptScore W160233724C45786274 @default.
- W160233724 hasConceptScore W160233724C48940184 @default.
- W160233724 hasConceptScore W160233724C50670333 @default.
- W160233724 hasConceptScore W160233724C53403541 @default.
- W160233724 hasConceptScore W160233724C55493867 @default.
- W160233724 hasConceptScore W160233724C62520636 @default.
- W160233724 hasConceptScore W160233724C69357855 @default.
- W160233724 hasConceptScore W160233724C85725439 @default.
- W160233724 hasConceptScore W160233724C97355855 @default.
- W160233724 hasLocation W1602337241 @default.
- W160233724 hasOpenAccess W160233724 @default.
- W160233724 hasPrimaryLocation W1602337241 @default.
- W160233724 hasRelatedWork W2020309182 @default.
- W160233724 hasRelatedWork W2041018691 @default.
- W160233724 hasRelatedWork W2087572532 @default.
- W160233724 hasRelatedWork W2295639835 @default.
- W160233724 hasRelatedWork W2323406752 @default.
- W160233724 hasRelatedWork W2461875948 @default.
- W160233724 hasRelatedWork W2804984244 @default.
- W160233724 hasRelatedWork W3146307661 @default.
- W160233724 hasRelatedWork W3204169216 @default.
- W160233724 hasRelatedWork W4283775057 @default.
- W160233724 isParatext "false" @default.
- W160233724 isRetracted "false" @default.
- W160233724 magId "160233724" @default.
- W160233724 workType "book-chapter" @default.