Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

Table mix-ins: ['Structure'] Extra columns: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-33140
  • Created at: Sept. 4, 2022, 3:51 p.m.
  • Last updated at: Sept. 4, 2022, 3:51 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 64
  • Number of elements: 3
  • Element list: ['Ag', 'Ga', 'Se']
  • Chemical System: Ag-Ga-Se
  • Density: 6.934651891150249
  • Atomic Density: 0.044124982446811074
  • Unit Cell Volume: 1450.425506166412
  • Molar Volume: 13.647916500044346
  • Full Formula: Ga4 Ag36 Se24
  • Reduced Formula: Ga(Ag3Se2)3
  • Formula Anonymous: AB6C9
  • Spacegroup Number: 198
  • Spacegroup Symbol: P2_13
  • Crystal System: cubic
  • Pointgroup: 23