Journal
PHYSICA SCRIPTA
Volume 91, Issue 5, Pages -Publisher
IOP PUBLISHING LTD
DOI: 10.1088/0031-8949/91/5/054003
Keywords
EXAFS; reverse Monte Carlo; evolutionary algorithm; copper nitride
Categories
Funding
- Latvian Science Council [187/2012]
- EC FP7 [226716, I-20110160 EC]
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Extended x-ray absorption fine structure (EXAFS) spectroscopy combined with reverse Monte Carlo (RMC) and evolutionary algorithm (EA) modelling is used to advance the understanding of the local structure and lattice dynamics of copper nitride (Cu3N). The RMC/EA-EXAFS method provides a possibility to probe correlations in the motion of neighboring atoms and allows us to analyze the influence of anisotropic motion of copper atoms in Cu3N.
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