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  1. Third-Parties
  2. MatprojStructure
  3. mp-760467

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-760467
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 27
  • Number of elements: 3
  • Element list: ['Th', 'U', 'O']
  • Chemical System: O-Th-U
  • Density: 11.084810852330227
  • Atomic Density: 0.0743470976652507
  • Unit Cell Volume: 363.1614528057039
  • Molar Volume: 8.100034768155725
  • Full Formula: Th1 U8 O18
  • Reduced Formula: ThU8O18
  • Formula Anonymous: AB8C18
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -289.54802356
  • Final energy per atom: -10.724000872592592
  • 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.