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  1. Third-Parties
  2. MatprojStructure
  3. mp-863300

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-863300
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 140
  • Number of elements: 5
  • Element list: ['Na', 'V', 'Si', 'W', 'O']
  • Chemical System: Na-O-Si-V-W
  • Density: 4.541671518404876
  • Atomic Density: 0.05992201945569217
  • Unit Cell Volume: 2336.369856551972
  • Molar Volume: 10.049962959697845
  • Full Formula: Na4 V2 Si2 W24 O108
  • Reduced Formula: Na2VSi(W2O9)6
  • Formula Anonymous: ABC2D12E54
  • Spacegroup Number: 85
  • Spacegroup Symbol: P4/n1
  • Crystal System: tetragonal
  • Pointgroup: 4/m

Thermodynamics:

  • Final energy: -1026.20016351
  • Final energy per atom: -7.330001167928572
  • 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.