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DFT+U calculations of crystal lattice, electronic structure, and phase stability under pressure of TiO2 polymorphs |
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| Authors: | Arroyo-de Dompablo M E Morales-García A Taravillo M |
| Institution: | Departamento de Qui?mica Inorga?nica, MALTA Consolider Team, Facultad de CC Qui?micas, Universidad Complutense de Madrid, Madrid, Spain. e.arroyo@quim.ucm.es |
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