Crystallography Open Database

Information card for entry 4330787

Preview

Coordinates	4330787.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	strontium calcium titanium oxyhydride
Chemical name	strontium calcium titanium oxyhydride
Formula	Ca0.6 H0.11 O2.89 Sr0.4 Ti
Calculated formula	Ca0.6 H0.105 O2.895 Sr0.4 Ti
Title of publication	Oxyhydrides of (Ca,Sr,Ba)TiO3 Perovskite Solid Solutions
Authors of publication	Tatsunori Sakaguchi; Yoji Kobayashi; Takeshi Yajima; Masatoshi Ohkura; Cédric Tassel; Fumitaka Takeiri; Shingo Mitsuoka; Hiroshi Ohkubo; Takafumi Yamamoto; Jung eun Kim; Naruki Tsuji; Akihiko Fujihara; Yoshitaka Matsushita; James Hester; Maxim Avdeev; Kenji Ohoyama; Hiroshi Kageyama
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	11371 - 11376
a	5.47021 ± 0.00006 Å
b	5.4611 ± 0.00006 Å
c	7.72283 ± 0.00001 Å
α	90°
β	90°
γ	90°
Cell volume	230.707 ± 0.004 Å³
Ambient diffraction temperature	300 K
Number of distinct elements	5
Space group number	62
Hermann-Mauguin space group symbol	P b n m
Hall space group symbol	-P 2c 2ab
Method of determination	powder diffraction
Diffraction radiation probe	neutron
Diffraction radiation wavelength	1.85 Å
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4330787.cif
80244	2013-04-07	cif/ Adding structures of 4330787 via cif-deposit CGI script.	4330787.cif