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  1. Third-Parties
  2. MatprojStructure
  3. mp-1200353

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-1200353
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 70
  • Number of elements: 6
  • Element list: ['Cs', 'K', 'U', 'Si', 'O', 'F']
  • Chemical System: Cs-F-K-O-Si-U
  • Density: 4.689798462252898
  • Atomic Density: 0.05448242183502053
  • Unit Cell Volume: 1284.8180686968838
  • Molar Volume: 11.053364658119978
  • Full Formula: Cs8 K6 U6 Si8 O40 F2
  • Reduced Formula: Cs4K3U3Si4O20F
  • Formula Anonymous: AB3C3D4E4F20
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -548.64983305
  • Final energy per atom: -7.8378547578571425
  • 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.