F-test in EXAFS fitting of structural models

被引:33
|
作者
Michalowicz, A [1 ]
Provost, K
Laruelle, S
Mimouni, A
Vlaic, G
机构
[1] Univ Paris 12, GPMD, F-94010 Creteil, France
[2] Univ Paris 06, GPMD, F-75252 Paris 05, France
[3] Univ Paris 06, Lab Mineral & Cristallog Paris, F-75252 Paris 05, France
[4] Univ Picardie, Lab React & Chim Solides, F-80039 Amiens, France
[5] Univ Trieste, Dipartimento Sci Chim, Trieste, Italy
[6] Sincrotrone Trieste, I-34012 Trieste, Italy
关键词
EXAFS fitting; statistical tests; best fit significance;
D O I
10.1107/S0909049599000734
中图分类号
TH7 [仪器、仪表];
学科分类号
0804 ; 080401 ; 081102 ;
摘要
The principles of the statistical F-test, used in EXAFS fitting in order to compare different models and eventually choose the more likely, are summarized. Examples, taken in the fields of inorganic chemistry and biochemical applications are discussed. F-test is shown to be very useful to check the statistical limits of a model and to discriminate between physically acceptable models. However, this tool is useless when the choice involves physically unrealistic solutions since it cannot prevent parameter variations out of their physically significant limits.
引用
收藏
页码:233 / 235
页数:3
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