Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-55791
- Created at: Sept. 4, 2022, 2:38 p.m.
- Last updated at: Sept. 4, 2022, 2:38 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 20
- Number of elements: 3
- Element list: ['Ti', 'Fe', 'O']
- Chemical System: Fe-O-Ti
- Density: 4.975838230610703
- Atomic Density: 0.098758020996882
- Unit Cell Volume: 202.51519621511497
- Molar Volume: 6.097875088232208
- Full Formula: Ti4 Fe4 O12
- Reduced Formula: TiFeO3
- Formula Anonymous: ABC3
- Spacegroup Number: 62
- Spacegroup Symbol: Pnma
- Crystal System: orthorhombic
- Pointgroup: mmm
