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  1. Third-Parties
  2. MatprojStructure
  3. mp-1103374

Entry Data

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-1103374
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Bi', 'Os', 'Se']
  • Chemical System: Bi-Os-Se
  • Density: 12.109138707232097
  • Atomic Density: 0.04575122454412699
  • Unit Cell Volume: 262.2880615670957
  • Molar Volume: 13.16279688687164
  • Full Formula: Bi4 Os4 Se4
  • Reduced Formula: BiOsSe
  • Formula Anonymous: ABC
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -76.07169574000001
  • Final energy per atom: -6.339307978333334
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.