Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-99409
- 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: 10
- Number of elements: 3
- Element list: ['Ba', 'Ca', 'N']
- Chemical System: Ba-Ca-N
- Density: 4.645129244173577
- Atomic Density: 0.040808165720783975
- Unit Cell Volume: 245.0489950570581
- Molar Volume: 14.757195413301483
- Full Formula: Ba4 Ca2 N4
- Reduced Formula: Ba2CaN2
- Formula Anonymous: AB2C2
- Spacegroup Number: 59
- Spacegroup Symbol: Pmmn1
- Crystal System: orthorhombic
- Pointgroup: mmm