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  1. Third-Parties
  2. MatprojStructure
  3. mp-1202693

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-1202693
  • 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: 36
  • Number of elements: 3
  • Element list: ['Ce', 'Se', 'N']
  • Chemical System: Ce-N-Se
  • Density: 6.584903991493506
  • Atomic Density: 0.043241505882672594
  • Unit Cell Volume: 832.5334482494433
  • Molar Volume: 13.926760035462008
  • Full Formula: Ce16 Se12 N8
  • Reduced Formula: Ce4Se3N2
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -274.55620048000003
  • Final energy per atom: -7.626561124444446
  • 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.