First-principles thermochemical properties of hexagonal and cubic phase BaMnO3
- Creator: Ghose, Krishna K. , Bayon, Alicia , Page, Alister J.
- Resource Type: journal article
- Date: 2022
Reaction pathways in the solid state and the Hubbard U correction
- Creator: Brown, Joshua J. , Page, Alister J.
- Resource Type: journal article
- Date: 2021
Density functional tight binding-based free energy simulations in the DFTB plus program
- Creator: Mitchell, Izaac , Aradi, Balint , Page, Alister J.
- Resource Type: journal article
- Date: 2018
Oxygen Vacancy Defect Migration in Titanate Perovskite Surfaces: Effect of the A-Site Cations
- Creator: Brown, Joshua J. , Ke, Zhuofeng , Geng, Wei , Page, Alister J.
- Resource Type: journal article
- Date: 2018