1988
DOI: 10.1016/0921-4534(88)90111-6
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Rietveld analysis of Tl2Ba2Can−1CunO4+2n (n=1, 2 and 3) by powder x-ray diffraction

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Cited by 91 publications
(15 citation statements)
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“…Let us compare the calculated results with experiment. The diffraction studies of Tl 2 Ba 2 CaCu 2 O 8 suggested the substitution of Ca for Tl [2][3][4]11]. The calculated energetics of possible antisite substitutions is in agreement with this result.…”
Section: Resultssupporting
confidence: 73%
See 1 more Smart Citation
“…Let us compare the calculated results with experiment. The diffraction studies of Tl 2 Ba 2 CaCu 2 O 8 suggested the substitution of Ca for Tl [2][3][4]11]. The calculated energetics of possible antisite substitutions is in agreement with this result.…”
Section: Resultssupporting
confidence: 73%
“…The authors of this paper showed that the force model provided a stable lattice dynamics and satisfactory agreement with some experimental phonon properties. We performed the relaxation of the perfect model crystallite and compared the final positions of the ions in the unit cell with the experimental ones [11]. The largest deviation from the experimental data is less than 0.3 Å.…”
Section: Theoretical Methodsmentioning
confidence: 99%
“…Figure 6 shows the crystal structure of Tl-2201 such as reported in Ref. [63]. The simplest way to explore the possible consequences of our hypothesis consists in dividing the structure into regions A and B (denoted in Fig.…”
Section: Possible Extension Of the Ilt Scenario For Single Layer Comp...mentioning
confidence: 97%
“…The impurity phases were identi"ed by EDS and characteristic XRD peaks to be small amounts of either the lower homologue 2201 (20), Ca CuO (21), Ba CuO (22), or BaCuO (23). The impurities found in the samples, added to the re"nements, are listed in Table 2.…”
Section: X-ray Powder Diwractionmentioning
confidence: 99%