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  1. Third-Parties
  2. MatprojStructure
  3. mp-1212194

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-1212194
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 46
  • Number of elements: 5
  • Element list: ['K', 'U', 'H', 'O', 'F']
  • Chemical System: F-H-K-O-U
  • Density: 4.2555942040045585
  • Atomic Density: 0.056443534749156074
  • Unit Cell Volume: 814.9737645672125
  • Molar Volume: 10.669318969414899
  • Full Formula: K4 U6 H8 O12 F16
  • Reduced Formula: K2U3H4(O3F4)2
  • Formula Anonymous: A2B3C4D6E8
  • Spacegroup Number: 40
  • Spacegroup Symbol: Ama2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -306.80709382000003
  • Final energy per atom: -6.6697194308695655
  • 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.