2013
DOI: 10.1017/s0885715613000717
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Structure of a new CaII1/3SbV1/6BiIII1/2PO4 phosphate

Abstract: A new Ca1/3Sb1/6Bi1/2PO4 “CaSb0.50Bi1.50(PO4)3” phosphate has been synthesized by conventional solid-state reaction techniques at 900 °C in air atmosphere. Their crystallographic structures were determined at room temperature from X-ray powder diffraction (XRPD) data using the Rietveld analysis. CaII1/3SbV1/6BiIII1/2PO4 material possesses the high-temperature BiPO4 monoclinic structure variety. It crystallizes in monoclinic system with P21/m space group and the cell parameters are: a = 4.9358(1) Å, b = 6.9953(… Show more

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Cited by 2 publications
(3 citation statements)
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“…Therefore, for the two positions, Ca and Bi atoms were fixed at the same position with the same atomic coordinates, and the equivalent isotropic displacement parameters were constrained the same as well. A similar situation of Bi 3+ /Ca 2+ or Bi 3+ /Sr 2+ occupying the same position has been observed in many compounds such as Bi 2 CaV 2 O 9 , Ca 3 Bi­(PO 4 ) 3 , , Ca 1/3 Sb 1/6 Bi 1/2 PO 4 , Sr 3 Bi­(PO 4 ) 3 , and Ca 1.25 Sr 0.75 Bi 3 Nb 2 O 11 Cl . The reason lies on a similar coordination geometry of Bi, Sr, and Ca atoms and their similar Bi–O, Ca–O, and Sr–O bond lengths as well.…”
Section: Methodssupporting
confidence: 68%
See 1 more Smart Citation
“…Therefore, for the two positions, Ca and Bi atoms were fixed at the same position with the same atomic coordinates, and the equivalent isotropic displacement parameters were constrained the same as well. A similar situation of Bi 3+ /Ca 2+ or Bi 3+ /Sr 2+ occupying the same position has been observed in many compounds such as Bi 2 CaV 2 O 9 , Ca 3 Bi­(PO 4 ) 3 , , Ca 1/3 Sb 1/6 Bi 1/2 PO 4 , Sr 3 Bi­(PO 4 ) 3 , and Ca 1.25 Sr 0.75 Bi 3 Nb 2 O 11 Cl . The reason lies on a similar coordination geometry of Bi, Sr, and Ca atoms and their similar Bi–O, Ca–O, and Sr–O bond lengths as well.…”
Section: Methodssupporting
confidence: 68%
“…However, the main challenge comes from the fact that most of the known bismuth phosphates tend to crystallize in centrosymmetric space groups, which limits their application as nonlinear optical (NLO) materials with the capability for frequency conversion. Mostly, the reason behind this is that the dipole moments produced by the BiO n polyhedra have been canceled by each other due to the antiparallel arrangement of Bi ions.…”
Section: Introductionmentioning
confidence: 99%
“…Recently [25]. It crystallizes with the high temperature BiPO 4 monoclinic structure variety (P2 1 /m space group).…”
Section: Introductionmentioning
confidence: 99%