HIGHLIGHTS
- who: DFT and collaborators from the Institute of Inorganic and Analytical, Johann Wolfgang Goethe University, Max-von-Laue-Strau00dfe, United Kingdom have published the article: Ambiguous structure determination from powder data: four different structural models of 4,11-diu00adfluorou00adquinacridone with similar X-ray powder patterns, fit to the PDF, SSNMR and DFT-D, in the Journal: IUCrJ (2022). 406-424 of /2022/
- what: The usefulness and efficacy of this approach has been demonstrated in many fields of science including, for example, pharmaceuticals (Smith et_al, 2001; Tatton et_al, 2018; Rahal et_al, 2021), biology (Reddy et_al, 2015 . . .
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