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  1. Third-Parties
  2. MatprojStructure
  3. mp-676629

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-676629
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 29
  • Number of elements: 3
  • Element list: ['Sm', 'Th', 'O']
  • Chemical System: O-Sm-Th
  • Density: 9.612926011992887
  • Atomic Density: 0.06821667984840928
  • Unit Cell Volume: 425.11596964911865
  • Molar Volume: 8.827959339830622
  • Full Formula: Sm2 Th8 O19
  • Reduced Formula: Sm2Th8O19
  • Formula Anonymous: A2B8C19
  • Spacegroup Number: 115
  • Spacegroup Symbol: P-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2

Thermodynamics:

  • Final energy: -285.65360415
  • Final energy per atom: -9.850124281034482
  • 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.