Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-12074
- Created at: Sept. 4, 2022, 2:37 p.m.
- Last updated at: Sept. 4, 2022, 2:37 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 6
- Number of elements: 3
- Element list: ['Ti', 'Cl', 'O']
- Chemical System: Cl-O-Ti
- Density: 3.357416187794919
- Atomic Density: 0.06107215573127947
- Unit Cell Volume: 98.2444442668816
- Molar Volume: 9.860697871052267
- Full Formula: Ti2 Cl2 O2
- Reduced Formula: TiClO
- Formula Anonymous: ABC
- Spacegroup Number: 59
- Spacegroup Symbol: Pmmn1
- Crystal System: orthorhombic
- Pointgroup: mmm
