Journal article
HUG and SQUEEZE: using CRYSTALS to incorporate resonant-scattering in the SQUEEZE structure factor contributions to determine absolute structure
- Abstract:
-
The resonant scattering contributions to single crystal X-ray diffraction data enables the absolute structure of crystalline materials to be determined.
Crystal structures can be determined even if they contain considerably disordered regions because a correction is available via a discrete Fourier transform of the residual electron density to approximate the X-ray scattering from the disordered region. However the corrected model can not normally account for resonant scat...
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- Publication status:
- Published
- Peer review status:
- Peer reviewed
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Funding
+ Engineering and Physical Sciences Research Council
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Funding agency for:
Cooper, RI
Grant:
EP/K013009/1
Bibliographic Details
- Publisher:
- International Union of Crystallography Publisher's website
- Journal:
- Acta Crystallographica Section C: Structural Chemistry Journal website
- Volume:
- C73
- Issue:
- 11
- Pages:
- 845-853
- Publication date:
- 2017-11-01
- Acceptance date:
- 2017-09-18
- DOI:
- ISSN:
-
2053-2296
Item Description
- Keywords:
- Pubs id:
-
pubs:729232
- UUID:
-
uuid:f8cf5a21-02cd-4f24-9619-729a254e940e
- Local pid:
- pubs:729232
- Source identifiers:
-
729232
- Deposit date:
- 2017-09-18
Terms of use
- Copyright holder:
- 2017 International Union of Crystallography
- Copyright date:
- 2017
- Notes:
- This is the publisher's version of the article. The final version is available online from International Union of Crystallography at: 10.1107/S2053229617013304
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