Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-96849
- 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: 40
- Number of elements: 4
- Element list: ['Ba', 'Cu', 'Se', 'O']
- Chemical System: Ba-Cu-O-Se
- Density: 4.757536235772082
- Atomic Density: 0.06299740691520304
- Unit Cell Volume: 634.9467693780088
- Molar Volume: 9.559347050754067
- Full Formula: Ba4 Cu4 Se8 O24
- Reduced Formula: BaCu(SeO3)2
- Formula Anonymous: ABC2D6
- Spacegroup Number: 31
- Spacegroup Symbol: Pmn2_1
- Crystal System: orthorhombic
- Pointgroup: mm2
