Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-84342
- Created at: Sept. 4, 2022, 3:33 p.m.
- Last updated at: Sept. 4, 2022, 3:33 p.m.
- Input Source: OQMD
Structure:
- Number of sites: 58
- Number of elements: 4
- Element list: ['Ba', 'Nd', 'O', 'Ti']
- Chemical System: Ba-Nd-O-Ti
- Density: 5.568175810460773
- Atomic Density: 0.0617066737855247
- Unit Cell Volume: 939.9307472250397
- Molar Volume: 9.759302180070982
- Full Formula: Ba12 Nd4 Ti8 O34
- Reduced Formula: Ba6Nd2Ti4O17
- Formula Anonymous: A2B4C6D17
- Spacegroup Number: 194
- Spacegroup Symbol: P6_3/mmc
- Crystal System: hexagonal
- Pointgroup: 6/mmm
