Ab initio solution of a complex crystal structure from powder-diffraction data using simulated-annealing method and a high degree of molecular flexibility
Author:
Publisher
American Physical Society (APS)
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevB.55.12011/fulltext
Reference14 articles.
1. Structure of the polymer electrolyte poly(ethylene oxide)3: LiN(SO2CF3)2 determined by powder diffraction using a powerful Monte Carlo approach
2. Solid State Lithium Cyanocobaltates with a High Capacity for Reversible Dioxygen Binding: Synthesis, Reactivity, and Structures
3. Crystal Structure Solution from Powder X-ray Diffraction Data: The Development of Monte Carlo Methods To Solve the Crystal Structure of the γ-Phase of 3-Chloro-trans-cinnamic Acid
4. Crystal Structure Determination from Powder Diffraction Data by Monte Carlo Methods
5. Trial-and-error computer methods for the indexing of unknown powder patterns
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