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  1. Third-Parties
  2. MatprojStructure
  3. mp-561037

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-561037
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 39
  • Number of elements: 5
  • Element list: ['K', 'U', 'Cr', 'N', 'O']
  • Chemical System: Cr-K-N-O-U
  • Density: 2.903685799119771
  • Atomic Density: 0.05824825172851921
  • Unit Cell Volume: 669.5479923031753
  • Molar Volume: 10.338749372372098
  • Full Formula: K8 U1 Cr4 N2 O24
  • Reduced Formula: K8UCr4(NO12)2
  • Formula Anonymous: AB2C4D8E24
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -273.55264802
  • Final energy per atom: -7.014170462051282
  • 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.