Iodate in calcite, aragonite and vaterite CaCO3: Insights from first-principles calculations

Metadata

Published
2018-01-01
DOI
  • 10.17632/vvypr24z7k.1
Publisher
Mendeley
Creator Name (e-Rad)
  • Redfern, Simon

Description

CIF files providing structure outputs from ab initio calculations of calcite, aragonite and vaterite with and without substituted iodine.Published asX F Feng, S A T Redfern (2018) Iodate in calcite, aragonite and vaterite CaCO3: Insights from first-principles calculations. Geochimica et Cosmochimica Acta THIS DATASET IS ARCHIVED AT DANS/EASY, BUT NOT ACCESSIBLE HERE. TO VIEW A LIST OF FILES AND ACCESS THE FILES IN THIS DATASET CLICK ON THE DOI-LINK ABOVE

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