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  1. Third-Parties
  2. MatprojStructure
  3. mp-1222175

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-1222175
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 21
  • Number of elements: 4
  • Element list: ['Mg', 'U', 'As', 'O']
  • Chemical System: As-Mg-O-U
  • Density: 3.3438437370854
  • Atomic Density: 0.04666527496254784
  • Unit Cell Volume: 450.01342040422935
  • Molar Volume: 12.904972197920598
  • Full Formula: Mg1 U2 As2 O16
  • Reduced Formula: MgU2(AsO8)2
  • Formula Anonymous: AB2C2D16
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -149.20139247999998
  • Final energy per atom: -7.104828213333333
  • 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.