The atomic structure and dynamics at the CaCO3 vaterite-water interface: A classical molecular dynamics study
Classical molecular and lattice dynamics were applied to explore the structure and dynamics of water on different surfaces of vaterite, the least abundant calcium carbonate polymorph. Surfaces were generated starting from the three possible structural models for vaterite (monoclinic, hexagonal/trigo...
| Main Authors: | , , |
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| Format: | Journal Article |
| Language: | English |
| Published: |
2021
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| Online Access: | http://purl.org/au-research/grants/arc/DP160100677 http://hdl.handle.net/20.500.11937/84846 |