Table mix-ins: ['Structure']
Extra columns: ['energy_above_hull']
Base Information:
- Database Entry ID: jvasp-5212
- 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: 28
- Number of elements: 5
- Element list: ['C', 'S', 'N', 'Cl', 'O']
- Chemical System: C-Cl-N-O-S
- Density: 2.0431744286637397
- Atomic Density: 0.05465128508030753
- Unit Cell Volume: 512.3392791012196
- Molar Volume: 11.019211627230254
- Full Formula: C4 S8 N4 Cl4 O8
- Reduced Formula: CS2NClO2
- Formula Anonymous: ABCD2E2
- Spacegroup Number: 29
- Spacegroup Symbol: Pca2_1
- Crystal System: orthorhombic
- Pointgroup: mm2
