Iodate in calcite, aragonite and vaterite CaCO3: Insights from first-principles calculations
Published: 31 December 2017| Version 1 | DOI: 10.17632/vvypr24z7k.1
Contributor:
Simon RedfernDescription
CIF files providing structure outputs from ab initio calculations of calcite, aragonite and vaterite with and without substituted iodine. Published as X F Feng, S A T Redfern (2018) Iodate in calcite, aragonite and vaterite CaCO3: Insights from first-principles calculations. Geochimica et Cosmochimica Acta
Files
Institutions
University of Cambridge Department of Earth Sciences
Categories
Crystal Structure, Ab Initio Calculation