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  1. Third-Parties
  2. MatprojStructure
  3. mp-1227821

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-1227821
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 88
  • Number of elements: 4
  • Element list: ['La', 'Te', 'Mo', 'O']
  • Chemical System: La-Mo-O-Te
  • Density: 3.4884838610871296
  • Atomic Density: 0.0599831433346102
  • Unit Cell Volume: 1467.0788342834994
  • Molar Volume: 10.039721870536304
  • Full Formula: La4 Te2 Mo12 O70
  • Reduced Formula: La2TeMo6O35
  • Formula Anonymous: AB2C6D35
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -598.0280556299999
  • Final energy per atom: -6.795773359431817
  • 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.