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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-86813
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 4
  • Element list: ['Mn', 'Bi', 'Se', 'I']
  • Chemical System: Bi-I-Mn-Se
  • Density: 6.553808763505566
  • Atomic Density: 0.03596215807323121
  • Unit Cell Volume: 278.0700752061818
  • Molar Volume: 16.745771340354125
  • Full Formula: Mn2 Bi2 Se4 I2
  • Reduced Formula: MnBiSe2I
  • Formula Anonymous: ABCD2
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m