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The partial structure with errors: a probabilistic treatment

Articolo
Data di Pubblicazione:
2005
Abstract:
The method of the joint probability distribution functions has been applied to the case in which observed ( with errors) and calculated structure factors are available, the latter referred to a part of the structure with finite errors in the coordinates, the thermal parameters and the scattering factors. Results obtained by other authors are confirmed and generalized. A new relationship is found to estimate the parameter sigma(A), affecting the reliability of the estimates of cos(phi - phi(p)). Some practical applications are described.
Tipologia CRIS:
01.01 Articolo in rivista
Keywords:
MAXIMUM-LIKELIHOOD; PHASES; REFINEMENT; SPACE
Elenco autori:
Moustiakimov, Marat; Giacovazzo, Carmelo; Carrozzini, Benedetta; DE CARO, Liberato; Caliandro, Rocco; Siliqi, Dritan; Cascarano, GIOVANNI LUCA
Autori di Ateneo:
CALIANDRO ROCCO
CARROZZINI BENEDETTA
DE CARO LIBERATO
SILIQI DRITAN
Link alla scheda completa:
https://iris.cnr.it/handle/20.500.14243/119853
Pubblicato in:
ACTA CRYSTALLOGRAPHICA. SECTION A
Journal
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