Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-40126
- Created at: Sept. 4, 2022, 2:37 p.m.
- Last updated at: Sept. 4, 2022, 2:37 p.m.
- Input Source: JARVIS
Structure:
- Number of sites: 28
- Number of elements: 3
- Element list: ['Ba', 'Nd', 'S']
- Chemical System: Ba-Nd-S
- Density: 4.86648629217371
- Atomic Density: 0.037025337597069385
- Unit Cell Volume: 756.2388844285986
- Molar Volume: 16.264917893622833
- Full Formula: Ba4 Nd8 S16
- Reduced Formula: Ba(NdS2)2
- Formula Anonymous: AB2C4
- Spacegroup Number: 62
- Spacegroup Symbol: Pnma
- Crystal System: orthorhombic
- Pointgroup: mmm