A density functional theory study of Fe(II)/Fe(III) distribution in single layer green rust: a cluster approach
Abstract Green rust (GR) is a potentially important compound for the reduction of heavy metal and organic pollutants in subsurface environment because of its high Fe(II) content, but many details of the actual reaction mechanism are lacking. The reductive capacity distribution within GR is a key to...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
BMC
2021-06-01
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| Series: | Geochemical Transactions |
| Subjects: | |
| Online Access: | https://doi.org/10.1186/s12932-021-00076-0 |