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Quantum Crystallography: Current Developments and Future Perspectives.
Genoni A, Bučinský L, Claiser N, Contreras-García J, Dittrich B, Dominiak PM, Espinosa E, Gatti C, Giannozzi P, Gillet JM, Jayatilaka D, Macchi P, Madsen AØ, Massa L, Matta CF, Merz KM Jr, Nakashima PNH, Ott H, Ryde U, Schwarz K, Sierka M, Grabowsky S. Genoni A, et al. Chemistry. 2018 Aug 1;24(43):10881-10905. doi: 10.1002/chem.201705952. Epub 2018 Jul 13. Chemistry. 2018. PMID: 29488652
When combined X-ray and polarized neutron diffraction data challenge high-level calculations: spin-resolved electron density of an organic radical.
Voufack AB, Claiser N, Lecomte C, Pillet S, Pontillon Y, Gillon B, Yan Z, Gillet JM, Marazzi M, Genoni A, Souhassou M. Voufack AB, et al. Among authors: genoni a. Acta Crystallogr B Struct Sci Cryst Eng Mater. 2017 Aug 1;73(Pt 4):544-549. doi: 10.1107/S2052520617008241. Epub 2017 Jul 28. Acta Crystallogr B Struct Sci Cryst Eng Mater. 2017. PMID: 28762966
Quantum crystallography.
Grabowsky S, Genoni A, Bürgi HB. Grabowsky S, et al. Among authors: genoni a. Chem Sci. 2017 Jun 1;8(6):4159-4176. doi: 10.1039/c6sc05504d. Epub 2017 Mar 27. Chem Sci. 2017. PMID: 28878872 Free PMC article. Review.
103 results