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Aragonite [CaCO3]

Structure Orthorhombic
Space Group : Pcmn (No. 62)
a=4.9614 Å, b=7.9671 Å, c=5.7404 Å
a=b=g=90.00
Z=4

Atomic Positional Parameters
Ca 4c 0.2500 0.4150  0.7597
C  4c 0.2500 0.7622 -0.0862
O1 4c 0.2500 0.9225 -0.0962
O2 8d 0.4736 0.6810 -0.0862

Reference
JPR De Villiers (1971) American Mineralogist, 56, 758-767

Mineral Chemistry
Aragonite, in contrast to calcite, has calcium ions coordinated by nine oxygens; each oxygen is bonded to three calciums. Aragonite has a more compact atomic arrangement than calcite and is the stable phase at high pressures and low temperatures. Shells of aragonite are formed by many living organisms - the pearl has the aragonite structure. Over time, aragonite deposited in sediments will transform to calcite.

Carbonates isostructural with aragonite include witherite (BaCO3), strontianite (SrCO3) and cerussite (PbCO3).

The CHIME figure shows calcium ions as large grey spheres, oxygens as small red spheres, and carbons as small light grey spheres. The unit cell is outlined.