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First order structural phase transition in CaFe$_2$As$_2$

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 Added by S. L. Bud'ko
 Publication date 2008
  fields Physics
and research's language is English




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CaFe$_2$As$_2$ has been synthesized and found to form in the tetragonal, ThCr$_2$Si$_2$ structure with lattice parameters $a = 3.912(68) AA$ and $c = 11.667(45) AA$. Upon cooling through 170 K, CaFe$_2$As$_2$ undergoes a first order, structural phase transition to a low temperature, orthorhombic phase with a $2 - 3$ K range of hysteresis and coexistence. This transition is clearly evident in microscopic, thermodynamic and transport measurements. CaFe$_2$As$_2$ is the third member of the AFe$_2$As$_2$ (A = Ba, Sr, Ca) family to exhibit such a dramatic phase transition and is a promising candidate for studies of doping induced superconductivity.



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We report the synthesis and basic physical properties of single crystals of CaFe2As2, an isostructural compound to BaFe2As2 which has been recently doped to produce superconductivity. CaFe2As2 crystalizes in the ThCr2Si2 structure with lattice parameters a = 3.907(4) A and c = 11.69(2) A. Magnetic susceptibility, resistivity, and heat capacity all show a first order phase transition at T_0 171 K. The magnetic susceptibility is nearly isotropic from 2 K to 350 K. The heat capacity data gives a Sommerfeld coefficient of 8.2 +- 0.3 mJ/molK2, and does not reveal any evidence for the presence of high frequency (> 300 K) optical phonon modes. The Hall coefficient is negative below the transition indicating dominant n-type carriers.
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