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  1. Third-Parties
  2. MatprojStructure
  3. mp-1199364

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-1199364
  • 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: 68
  • Number of elements: 4
  • Element list: ['K', 'U', 'S', 'O']
  • Chemical System: K-O-S-U
  • Density: 3.270023601689379
  • Atomic Density: 0.05849116968999453
  • Unit Cell Volume: 1162.5686468641786
  • Molar Volume: 10.295811815557082
  • Full Formula: K8 U4 S8 O48
  • Reduced Formula: K2U(SO6)2
  • Formula Anonymous: AB2C2D12
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -460.65950916
  • Final energy per atom: -6.774404546470588
  • 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.