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Successful strategy for high degree of freedom crystal structure determination from powder X-ray diffraction data: a case study for selexipag form I with 38 DOF

  1. 1.
    SYSNO0507836
    TitleSuccessful strategy for high degree of freedom crystal structure determination from powder X-ray diffraction data: a case study for selexipag form I with 38 DOF
    Author(s) Hušák, M. (CZ)
    Jegorov, A. (CZ)
    Czernek, Jiří (UMCH-V) [STRUCTURE] RID
    Rohlíček, J. (CZ)
    Žižková, S. (CZ)
    Vraspír, P. (CZ)
    Kolesa, P. (CZ)
    Fitch, A. (FR)
    Brus, Jiří (UMCH-V) [STRUCTURE] RID, ORCID
    Corespondence/seniorHušák, M. - Korespondující autor
    Brus, Jiří - Korespondující autor
    Source Title Crystal Growth & Design. Roč. 19, č. 8 (2019), s. 4625-4631. - : AMER CHEMICAL SOC
    Document TypeČlánek v odborném periodiku
    Grant LTAUSA18011 GA MŠk - Ministry of Education, Youth and Sports (MEYS), CZ - Czech Republic
    Institutional supportUMCH-V - RVO:61389013
    Languageeng
    CountryUS
    Keywords powder X-ray diffraction * DFT methods
    URLhttps://pubs.acs.org/doi/10.1021/acs.cgd.9b00517
    Permanent Linkhttp://hdl.handle.net/11104/0298863
     
Number of the records: 1