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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-10877
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 14
  • Number of elements: 3
  • Element list: ['Ba', 'Ge', 'Se']
  • Chemical System: Ba-Ge-Se
  • Density: 5.013925426052604
  • Atomic Density: 0.031873188948819464
  • Unit Cell Volume: 439.2406427383395
  • Molar Volume: 18.894064129165375
  • Full Formula: Ba4 Ge2 Se8
  • Reduced Formula: Ba2GeSe4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m