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  1. Third-Parties
  2. MatprojStructure
  3. mp-647243

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-647243
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 30
  • Number of elements: 3
  • Element list: ['Tm', 'Ga', 'Os']
  • Chemical System: Ga-Os-Tm
  • Density: 10.520233611339062
  • Atomic Density: 0.05918058089258815
  • Unit Cell Volume: 506.92304042181576
  • Molar Volume: 10.17587301302448
  • Full Formula: Tm4 Ga20 Os6
  • Reduced Formula: Tm2Ga10Os3
  • Formula Anonymous: A2B3C10
  • Spacegroup Number: 127
  • Spacegroup Symbol: P4/mbm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -158.23727746
  • Final energy per atom: -5.274575915333333
  • 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.