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  1. Third-Parties
  2. MatprojStructure
  3. mp-1199610

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-1199610
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 68
  • Number of elements: 4
  • Element list: ['Co', 'S', 'N', 'O']
  • Chemical System: Co-N-O-S
  • Density: 1.5104616270244966
  • Atomic Density: 0.04587351123151403
  • Unit Cell Volume: 1482.3369342019232
  • Molar Volume: 13.127708340457119
  • Full Formula: Co4 S8 N20 O36
  • Reduced Formula: CoS2N5O9
  • Formula Anonymous: AB2C5D9
  • Spacegroup Number: 19
  • Spacegroup Symbol: P2_12_121
  • Crystal System: orthorhombic
  • Pointgroup: 222

Thermodynamics:

  • Final energy: -389.45329235
  • Final energy per atom: -5.727254299264707
  • 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.