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  1. Third-Parties
  2. MatprojStructure
  3. mp-1179503

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-1179503
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 62
  • Number of elements: 4
  • Element list: ['U', 'S', 'N', 'O']
  • Chemical System: N-O-S-U
  • Density: 4.2505899914500285
  • Atomic Density: 0.056348066331463616
  • Unit Cell Volume: 1100.3039507210287
  • Molar Volume: 10.687395596816351
  • Full Formula: U8 S4 N8 O42
  • Reduced Formula: U4S2N4O21
  • Formula Anonymous: A2B4C4D21
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -490.3178995
  • Final energy per atom: -7.908353217741936
  • 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.