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  1. Third-Parties
  2. MatprojStructure
  3. mp-1212211

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-1212211
  • 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: 34
  • Number of elements: 4
  • Element list: ['K', 'P', 'C', 'O']
  • Chemical System: C-K-O-P
  • Density: 1.164608413314269
  • Atomic Density: 0.03516736999806936
  • Unit Cell Volume: 966.8053084966704
  • Molar Volume: 17.124228397888743
  • Full Formula: K2 P8 C8 O16
  • Reduced Formula: KP4(CO2)4
  • Formula Anonymous: AB4C4D8
  • Spacegroup Number: 141
  • Spacegroup Symbol: I4_1/amd
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -203.2632095
  • Final energy per atom: -5.97832969117647
  • 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.