Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-71004
- Created at: Sept. 4, 2022, 2:35 p.m.
- Last updated at: Sept. 4, 2022, 2:35 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 4
- Number of elements: 3
- Element list: ['Ti', 'Be', 'Cl']
- Chemical System: Be-Cl-Ti
- Density: 3.2449765077317547
- Atomic Density: 0.05575412073148058
- Unit Cell Volume: 71.74357603565382
- Molar Volume: 10.80124783781175
- Full Formula: Ti2 Be1 Cl1
- Reduced Formula: Ti2BeCl
- Formula Anonymous: ABC2
- Spacegroup Number: 99
- Spacegroup Symbol: P4mm
- Crystal System: tetragonal
- Pointgroup: 4mm