Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-112062
- 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: 42
- Number of elements: 4
- Element list: ['Ti', 'H', 'C', 'O']
- Chemical System: C-H-O-Ti
- Density: 1.3796777980979924
- Atomic Density: 0.11942800795316737
- Unit Cell Volume: 351.67630039069167
- Molar Volume: 5.04248614978283
- Full Formula: Ti1 H24 C13 O4
- Reduced Formula: TiH24C13O4
- Formula Anonymous: AB4C13D24
- Spacegroup Number: 1
- Spacegroup Symbol: P1
- Crystal System: triclinic
- Pointgroup: 1
