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Flexibility of zeolitic imidazolate framework structures studied by neutron total scattering and the reverse Monte Carlo method.

Abstract:

The zeolitic imidazolate framework ZIF-4 undergoes an amorphization transition at about 600 K, and then transforms at about 700 K to ZIF-zni, the densest of the crystalline ZIFs. This series of long-range structural rearrangements must give a corresponding series of changes in the local structure, but these have not previously been directly investigated. Through analysis of neutron total diffraction data by reverse Monte Carlo modelling, we assess the changes in flexibility across this series...

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Publication status:
Published

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Journal:
Journal of physics. Condensed matter : an Institute of Physics journal More from this journal
Volume:
25
Issue:
39
Pages:
395403
Publication date:
2013-10-01
DOI:
EISSN:
1361-648X
ISSN:
0953-8984
Language:
English
Pubs id:
pubs:430055
UUID:
uuid:a9d330ca-f296-42e4-87b9-56af467782a5
Local pid:
pubs:430055
Source identifiers:
430055
Deposit date:
2013-11-17

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