Table mix-ins: ['Structure']
Extra columns: ['formation_energy']
Base Information:
- Database Entry ID: oqmd-69619
- 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: 4
- Element list: ['Cu', 'K', 'P', 'Se']
- Chemical System: Cu-K-P-Se
- Density: 3.8512448246853155
- Atomic Density: 0.03755928706071031
- Unit Cell Volume: 1916.9692940023117
- Molar Volume: 16.03369294594409
- Full Formula: K12 Cu12 P12 Se36
- Reduced Formula: KCuPSe3
- Formula Anonymous: ABCD3
- Spacegroup Number: 14
- Spacegroup Symbol: P12_1/c1
- Crystal System: monoclinic
- Pointgroup: 2/m
