First-principles molecular dynamics simulation study on Ti4+ ion in aqueous sulfuric acid
A first-principles molecular dynamics simulation study was carried out to investigate the structural features of Ti4+ in aqueous sulfuric acid. Ti4+ forms several stoichiometric compounds in aqueous sulfuric acid, the identity and structural information details of which have been the subject of nume...
| Main Authors: | , , , , , , |
|---|---|
| Format: | Article |
| Language: | English |
| Published: |
AIP Publishing LLC
2021-03-01
|
| Series: | AIP Advances |
| Online Access: | http://dx.doi.org/10.1063/5.0038061 |