Table mix-ins: ['Structure', 'Thermodynamics']
Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']
Base Information:
- Database Entry ID: mp-1204081
- Created at: Sept. 4, 2022, 2:47 p.m.
- Last updated at: Nov. 28, 2021, 1:38 a.m.
- Input Source: Materials Project
Structure:
- Number of sites: 180
- Number of elements: 8
- Element list: ['Cu', 'Mo', 'H', 'C', 'S', 'I', 'N', 'O']
- Chemical System: C-Cu-H-I-Mo-N-O-S
- Density: 2.194279535358995
- Atomic Density: 0.06409328483228244
- Unit Cell Volume: 2808.406535427527
- Molar Volume: 9.395899704249164
- Full Formula: Cu12 Mo4 H96 C32 S12 I12 N8 O4
- Reduced Formula: Cu3MoH24C8S3I3N2O
- Formula Anonymous: ABC2D3E3F3G8H24
- Spacegroup Number: 14
- Spacegroup Symbol: P12_1/c1
- Crystal System: monoclinic
- Pointgroup: 2/m