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  1. Third-Parties
  2. MatprojStructure
  3. mp-1192173

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-1192173
  • 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: 24
  • Number of elements: 3
  • Element list: ['La', 'Co', 'S']
  • Chemical System: Co-La-S
  • Density: 4.782800576351373
  • Atomic Density: 0.04553559515652689
  • Unit Cell Volume: 527.060202408707
  • Molar Volume: 13.225128032913855
  • Full Formula: La6 Co4 S14
  • Reduced Formula: La3Co2S7
  • Formula Anonymous: A2B3C7
  • Spacegroup Number: 173
  • Spacegroup Symbol: P6_3
  • Crystal System: hexagonal
  • Pointgroup: 6

Thermodynamics:

  • Final energy: -157.02180612
  • Final energy per atom: -6.542575255
  • 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.