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  1. Third-Parties
  2. MatprojStructure
  3. mp-16882

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-16882
  • 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: 36
  • Number of elements: 3
  • Element list: ['Zn', 'Mo', 'O']
  • Chemical System: Mo-O-Zn
  • Density: 4.096277163085238
  • Atomic Density: 0.06568110903807106
  • Unit Cell Volume: 548.1028034884908
  • Molar Volume: 9.168756204328643
  • Full Formula: Zn6 Mo6 O24
  • Reduced Formula: ZnMoO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -260.50575097
  • Final energy per atom: -7.236270860277778
  • 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.