Refinement of the crystal structures of Cu6O8InCl and Cu6 O8Cu2Cl by neutron powder diffraction

Hiroshi Hayakawa; Etsuo Akiba; Shuitiro Ono; Hideo Ihara; Fujio Izumi; Hajime Asano

doi:10.2109/jcersj.101.745

Refinement of the crystal structures of Cu₆O₈InCl and Cu₆ O₈Cu₂Cl by neutron powder diffraction

Hiroshi Hayakawa, Etsuo Akiba, Shuitiro Ono, Hideo Ihara, Fujio Izumi, Hajime Asano

Research output: Contribution to journal › Article › peer-review

1 Citation (Scopus)

Abstract

Two titled compounds which have different structures have been synthesized by heating mixtures of hydrates of copper (II) nitrate and copper (II) chloride, or indium nitrate. Their crystal structures have been refined by the Rietveld method using neutron powder diffraction data. Cu₆O₈InCl is a stoichiometric compound and has a murdochite-like structure. The crystal structure of Cu₆O₈Cu₂Cl is essentially the same as that of Cu₆O₈InCl except Cu sites corresponding to the In sites. The cu atoms are not located at the In site (2b) in the cube, but distributed among 6 equivalent sites (24e) around the center of the oxygen cube with an occupation factor of about 0.29.

Original language	English
Pages (from-to)	745-751
Number of pages	7
Journal	Nippon Seramikkusu Kyokai Gakujutsu Ronbunshi/Journal of the Ceramic Society of Japan
Volume	101
Issue number	1175
DOIs	https://doi.org/10.2109/jcersj.101.745
Publication status	Published - 1993
Externally published	Yes

All Science Journal Classification (ASJC) codes

Ceramics and Composites
Chemistry(all)
Condensed Matter Physics
Materials Chemistry

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10.2109/jcersj.101.745

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title = "Refinement of the crystal structures of Cu6O8InCl and Cu6 O8Cu2Cl by neutron powder diffraction",

abstract = "Two titled compounds which have different structures have been synthesized by heating mixtures of hydrates of copper (II) nitrate and copper (II) chloride, or indium nitrate. Their crystal structures have been refined by the Rietveld method using neutron powder diffraction data. Cu6O8InCl is a stoichiometric compound and has a murdochite-like structure. The crystal structure of Cu6O8Cu2Cl is essentially the same as that of Cu6O8InCl except Cu sites corresponding to the In sites. The cu atoms are not located at the In site (2b) in the cube, but distributed among 6 equivalent sites (24e) around the center of the oxygen cube with an occupation factor of about 0.29.",

author = "Hiroshi Hayakawa and Etsuo Akiba and Shuitiro Ono and Hideo Ihara and Fujio Izumi and Hajime Asano",

year = "1993",

doi = "10.2109/jcersj.101.745",

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journal = "Nippon Seramikkusu Kyokai Gakujutsu Ronbunshi/Journal of the Ceramic Society of Japan",

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TY - JOUR

T1 - Refinement of the crystal structures of Cu6O8InCl and Cu6 O8Cu2Cl by neutron powder diffraction

AU - Hayakawa, Hiroshi

AU - Akiba, Etsuo

AU - Ono, Shuitiro

AU - Ihara, Hideo

AU - Izumi, Fujio

AU - Asano, Hajime

PY - 1993

Y1 - 1993

N2 - Two titled compounds which have different structures have been synthesized by heating mixtures of hydrates of copper (II) nitrate and copper (II) chloride, or indium nitrate. Their crystal structures have been refined by the Rietveld method using neutron powder diffraction data. Cu6O8InCl is a stoichiometric compound and has a murdochite-like structure. The crystal structure of Cu6O8Cu2Cl is essentially the same as that of Cu6O8InCl except Cu sites corresponding to the In sites. The cu atoms are not located at the In site (2b) in the cube, but distributed among 6 equivalent sites (24e) around the center of the oxygen cube with an occupation factor of about 0.29.

AB - Two titled compounds which have different structures have been synthesized by heating mixtures of hydrates of copper (II) nitrate and copper (II) chloride, or indium nitrate. Their crystal structures have been refined by the Rietveld method using neutron powder diffraction data. Cu6O8InCl is a stoichiometric compound and has a murdochite-like structure. The crystal structure of Cu6O8Cu2Cl is essentially the same as that of Cu6O8InCl except Cu sites corresponding to the In sites. The cu atoms are not located at the In site (2b) in the cube, but distributed among 6 equivalent sites (24e) around the center of the oxygen cube with an occupation factor of about 0.29.

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JO - Nippon Seramikkusu Kyokai Gakujutsu Ronbunshi/Journal of the Ceramic Society of Japan

JF - Nippon Seramikkusu Kyokai Gakujutsu Ronbunshi/Journal of the Ceramic Society of Japan

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ER -

Refinement of the crystal structures of Cu₆O₈InCl and Cu₆ O₈Cu₂Cl by neutron powder diffraction

Abstract

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