2011
DOI: 10.1007/s11669-011-9951-5
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Thermodynamic Assessment of the Cu-Fe-O System

Abstract: The system Cu-F-O was assessed with CALPHAD technique using computerized optimization procedure (PARROT). Two solid phases CuFe 2 O 4 and Fe 3 O 4 forming solid solution at high temperatures were modeled with compound energy formalism. Presence of Cu 1+ on tetrahedral sites in the samples with compositions close to CuFe 5 O 8 reported in the literature was taken into account. The second ternary compound, CuFeO 2 , was modeled as a stoichiometric phase. For the liquid phase, an ionic two-sublattice model was us… Show more

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Cited by 32 publications
(17 citation statements)
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“…The authors of reference [33] include several of the authors of the FactSage [24] thermodynamic system, and consequently the FactSage calculations that are used in the present paper are in good agreement with both prior assessments [32,33] -except the circumstance that FactSage so far contains no data for Cu 2+ (CuO) in the melt. Nevertheless, under the growth conditions for CuFeO 2 the CuO content was found to be low, < 10% [2], which agrees well with the literature (see Fig.…”
Section: Discussionsupporting
confidence: 74%
“…The authors of reference [33] include several of the authors of the FactSage [24] thermodynamic system, and consequently the FactSage calculations that are used in the present paper are in good agreement with both prior assessments [32,33] -except the circumstance that FactSage so far contains no data for Cu 2+ (CuO) in the melt. Nevertheless, under the growth conditions for CuFeO 2 the CuO content was found to be low, < 10% [2], which agrees well with the literature (see Fig.…”
Section: Discussionsupporting
confidence: 74%
“…Delafossite has typically needle-like structure [21] when it precipitates homogeneously in the glassy slag matrix or nucleates on spinel crystals below about 1170-1100 °C, depending on the prevailing oxygen partial pressure [22].…”
Section: Discussionmentioning
confidence: 99%
“…Fe þ 3 was later replaced by neutral FeO 1.5 species [6], resulting in the (Fe þ 2 ,) P (O -2 , FeO 1.5 , Va -Q ) Q formula unit of the solution. In this form the model was accepted by several authors and used to optimize higher-order systems [18][19][20].…”
Section: Liquidmentioning
confidence: 99%