Inorganic Solid Phases

(Na_4.97K_0.07Ca_0.48)[Al_5.62Si_10.29]O₃₂·11.91H₂O (K_0.1Na_4.6Ca_0.5Al_5.7Si_10.3O₃₂[H₂O]_11.9, p = 0.8(1) GPa) Crystal Structure

Get Access CIF Download help (pdf)

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

General Information

Phase Label(s): K_0.1Na_4.6Ca_0.5Al_5.7Si_10.3O₃₂[H₂O]_11.9
Structure Class(es): zeolite GIS
Classification by Properties: –
Mineral Name(s): gobbinsite
Pearson Symbol: oP84
Space Group: 62
Phase Prototype: Na₄(Al_0.25Si_0.75)₁₆O₃₂[H₂O]₁₄
Measurement Detail(s): automatic diffractometer; Oxford Diffraction Xcalibur (determination of structural parameters), X-rays, Mo Kα (determination of structural parameters), p = 0.8(1) GPa (determination of structural parameters)
Phase Class(es): –
Compound Class(es): silicate, hydrate
Interpretation Detail(s): positions of non-H atoms determined; pressure dependence studied, full-matrix least-squares refinement on F²; 41 variables; 303 reflections; F > 4σ(F), R = 0.0991; wR = 0.1485
Sample Detail(s): gobbinsite sample from Australia, Victoria, Melbourne, Bundoora, electron microprobe analysis; (Na_4.97K_0.07Ca_0.48)[Al_5.62Si_10.29]O₃₂[H₂O]_11.91, single crystal, 0.080×0.180×0.220 mm³ (determination of structural parameters)

Substance Summary

Standard Formula: K_0.07Na_4.97Ca_0.48Al_5.62Si_10.29O₃₂[H₂O]_11.91
Alphabetic Formula: Al_5.62Ca_0.48[H₂O]_11.91K_0.07Na_4.97O₃₂Si_10.29
Published Formula: (Na_4.97K_0.07Ca_0.48)[Al_5.62Si_10.29]O₃₂·11.91H₂O
Refined Formula: Al_5.65Ca_1.39H_20.96Na_4.71O_42.48Si_10.35
Wyckoff Sequence: 62,d⁷c⁷
Z Formula Units: 1
Density: ρ = 2.19 Mg·m⁻³

View 3D Interactive Structure

Cite this page

Citation

Crystallographic Data

Cell Parameters

	Published Data	Standardized Data
	Published Data	Unit Cell	Niggli-Reduced Cell
Space Group	Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial
a
b
c
α
β
γ
a/b
b/c
c/a
V

Atom Coordinates

Standardized

Site	Element	Wyckoff Symbol	Symmetry	X	Y	Z	Occupation	Co-ord. No.	Atomic Env.
Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial

Published

Site	Element	Wyckoff Symbol	Symmetry	X	Y	Z	Occupation
Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial

Displacement Parameters

Isotropic

Site	Published U [nm²]	Type	Computed B_eq [nm²]
Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial

Experimental Details

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

Reference

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

3D Interactive Structure

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

About this content

Database name

PAULING FILE Multinaries Edition – 2012

Dataset ID

sd_1022215

Copyright

©Springer & Material Phases Data System (MPDS), Switzerland & National Institute for Materials Science (NIMS), Japan, 2016

Chief Editor

Pierre Villars, Material Phases Data System (MPDS), CH-6354 Vitznau, Switzerland

villars.mpds@bluewin.ch

Credits

SpringerMaterials Release 2016.

Project Coordinator: Shuichi Iwata

Section-Editor: Karin Cenzual (Crystal Structures)

Cite this content

Pierre Villars (Chief Editor), PAULING FILE in: Inorganic Solid Phases, SpringerMaterials (online database), Springer, Heidelberg (ed.) SpringerMaterials (Na4.97K0.07Ca0.48)[Al5.62Si10.29]O32·11.91H2O (K0.1Na4.6Ca0.5Al5.7Si10.3O32[H2O]11.9, p = 0.8(1) GPa) Crystal Structure sd_1022215 (Springer-Verlag GmbH, Heidelberg, © 2016)

Download this citation

Citation copied