Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-56694
- 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: 28
- Number of elements: 5
- Element list: ['Ba', 'Fe', 'P', 'O', 'F']
- Chemical System: Ba-F-Fe-O-P
- Density: 4.0659511368506065
- Atomic Density: 0.07436705031388613
- Unit Cell Volume: 376.51083217390595
- Molar Volume: 8.097861532199994
- Full Formula: Ba2 Fe4 P4 O14 F4
- Reduced Formula: BaFe2P2O7F2
- Formula Anonymous: AB2C2D2E7
- Spacegroup Number: 59
- Spacegroup Symbol: Pmmn1
- Crystal System: orthorhombic
- Pointgroup: mmm
