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American Institute of Physics, Applied Physics Letters, 4(110), p. 041905, 2017

DOI: 10.1063/1.4974941

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Structural transitions of ordered kesterite-type Cu$_{2}$ZnSnS$_{4}$ under pressure

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This paper is available in a repository.

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Abstract

SeriesInformation ; Applied physics letters 110(4), 041905 (2017). doi:10.1063/1.4974941 ; Abstract ; We have investigated the high-pressure structural and vibrational behavior of the ordered kesterite-type Cu$_{2}$ZnSnS$_{4}$ compound. Our investigations have revealed two structural transitions: a kesterite-to-disordered kesterite transition was observed between 7 and 9 GPa, which involves a Zn/Cu disorder within the respective cationic sublattice, whereas a rocksalt-type structure was realized at ∼15 GPa. The latter transition is accompanied by a cationic coordination increase from fourfold-to-sixfold with respect to the sulfur anions. The predicted kesterite-to-stannite transition was not detected. Furthermore, our high-pressure Raman studies have shown that the aforementioned Zn/Cu cationic disorder will always be present in Cu$_{2}$ZnSnS$_{4}$ under relatively moderate compression. ; Other ; Published by AIP Publishing , Melville, NY