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  1. Third-Parties
  2. MatprojStructure
  3. mp-1222998

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-1222998
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 19
  • Number of elements: 4
  • Element list: ['Li', 'Nb', 'W', 'O']
  • Chemical System: Li-Nb-O-W
  • Density: 4.3807906653652715
  • Atomic Density: 0.06464719913842769
  • Unit Cell Volume: 293.9029107713653
  • Molar Volume: 9.315393149678327
  • Full Formula: Li2 Nb2 W2 O13
  • Reduced Formula: Li2Nb2W2O13
  • Formula Anonymous: A2B2C2D13
  • Spacegroup Number: 44
  • Spacegroup Symbol: Imm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -158.41277602
  • Final energy per atom: -8.337514527368421
  • 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.