Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-660895
- Created at: Sept. 4, 2022, 3:33 p.m.
- Last updated at: Sept. 4, 2022, 3:33 p.m.
- Input Source: OQMD
Structure:
- Number of sites: 72
- Number of elements: 3
- Element list: ['Ba', 'Mo', 'Se']
- Chemical System: Ba-Mo-Se
- Density: 6.518537858350027
- Atomic Density: 0.04397020939223262
- Unit Cell Volume: 1637.4723021609916
- Molar Volume: 13.6959565197427
- Full Formula: Ba4 Mo30 Se38
- Reduced Formula: Ba2Mo15Se19
- Formula Anonymous: A2B15C19
- Spacegroup Number: 167
- Spacegroup Symbol: R-3cH
- Crystal System: trigonal
- Pointgroup: -3m
