Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-689149
- Created at: Sept. 4, 2022, 3:52 p.m.
- Last updated at: Sept. 4, 2022, 3:52 p.m.
- Input Source: OQMD
Structure:
- Number of sites: 92
- Number of elements: 4
- Element list: ['H', 'N', 'O', 'S']
- Chemical System: H-N-O-S
- Density: 2.1419048998679404
- Atomic Density: 0.12941998051325726
- Unit Cell Volume: 710.8639611530145
- Molar Volume: 4.653176994863724
- Full Formula: H44 S8 N12 O28
- Reduced Formula: H11S2N3O7
- Formula Anonymous: A2B3C7D11
- Spacegroup Number: 33
- Spacegroup Symbol: Pna2_1
- Crystal System: orthorhombic
- Pointgroup: mm2
