Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-101891
- Created at: Sept. 4, 2022, 2:36 p.m.
- Last updated at: Sept. 4, 2022, 2:36 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 39
- Number of elements: 4
- Element list: ['Ti', 'H', 'C', 'O']
- Chemical System: C-H-O-Ti
- Density: 1.385540563529384
- Atomic Density: 0.11698443611448284
- Unit Cell Volume: 333.3776807868183
- Molar Volume: 5.14781364087325
- Full Formula: Ti1 H22 C12 O4
- Reduced Formula: TiH22(C3O)4
- Formula Anonymous: AB4C12D22
- Spacegroup Number: 1
- Spacegroup Symbol: P1
- Crystal System: triclinic
- Pointgroup: 1
