Počet záznamů: 1
Ab initio reconstruction of difference densities by charge flipping
- 1.0366995 - FZÚ 2012 RIV DK eng J - Článek v odborném periodiku
Palatinus, Lukáš - Fleischer, F. - Pattison, P. - Weber, T. - Steurer, W.
Ab initio reconstruction of difference densities by charge flipping.
Acta Crystallographica Section A. Roč. 67, č. 1 (2011), s. 9-20. ISSN 0108-7673. E-ISSN 2053-2733
Výzkumný záměr: CEZ:AV0Z10100521
Klíčová slova: structure solution * superstructure * band flipping
Kód oboru RIV: BM - Fyzika pevných látek a magnetismus
Impakt faktor: 2.076, rok: 2011
The charge flipping algorithm in its ”band flipping” variant is used to reconstruct density difference between a superstructure and average structure from superstructure reflections only. This technique can be used for structure solution of superstructures, some types of twins and intergrowths of polytypes as well as for solution of modulated structures and superstructures of quasicrystals.
Trvalý link: http://hdl.handle.net/11104/0201799
Počet záznamů: 1