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  1. Third-Parties
  2. MatprojStructure
  3. mp-1216211

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-1216211
  • 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: 29
  • Number of elements: 4
  • Element list: ['Zn', 'Co', 'C', 'N']
  • Chemical System: C-Co-N-Zn
  • Density: 1.8848934323018192
  • Atomic Density: 0.052559566102502314
  • Unit Cell Volume: 551.7549354087863
  • Molar Volume: 11.457744434677307
  • Full Formula: Zn3 Co2 C12 N12
  • Reduced Formula: Zn3Co2(CN)12
  • Formula Anonymous: A2B3C12D12
  • Spacegroup Number: 115
  • Spacegroup Symbol: P-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2

Thermodynamics:

  • Final energy: -220.47864128
  • Final energy per atom: -7.602711768275862
  • 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.