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  1. Third-Parties
  2. MatprojStructure
  3. mp-766007

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-766007
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 30
  • Number of elements: 3
  • Element list: ['Zr', 'U', 'O']
  • Chemical System: O-U-Zr
  • Density: 9.829568283565534
  • Atomic Density: 0.07858227733680939
  • Unit Cell Volume: 381.76546947625104
  • Molar Volume: 7.663484648311558
  • Full Formula: Zr3 U7 O20
  • Reduced Formula: Zr3U7O20
  • Formula Anonymous: A3B7C20
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -314.83928818
  • Final energy per atom: -10.494642939333334
  • 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.