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  1. Third-Parties
  2. MatprojStructure
  3. mp-1222255

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-1222255
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 25
  • Number of elements: 5
  • Element list: ['Mg', 'Ti', 'Nb', 'Pb', 'O']
  • Chemical System: Mg-Nb-O-Pb-Ti
  • Density: 7.705894787954597
  • Atomic Density: 0.07334164982183478
  • Unit Cell Volume: 340.8704339312145
  • Molar Volume: 8.211078936224217
  • Full Formula: Mg1 Ti2 Nb2 Pb5 O15
  • Reduced Formula: MgTi2Nb2(PbO3)5
  • Formula Anonymous: AB2C2D5E15
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -194.31177858
  • Final energy per atom: -7.772471143200001
  • 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.