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  1. Third-Parties
  2. MatprojStructure
  3. mp-18540

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-18540
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 22
  • Number of elements: 4
  • Element list: ['Cs', 'Er', 'Cu', 'S']
  • Chemical System: Cs-Cu-Er-S
  • Density: 5.869752726216397
  • Atomic Density: 0.047512180561151626
  • Unit Cell Volume: 463.03915627876523
  • Molar Volume: 12.674940802283464
  • Full Formula: Cs2 Er4 Cu6 S10
  • Reduced Formula: CsEr2Cu3S5
  • Formula Anonymous: AB2C3D5
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -118.13667342
  • Final energy per atom: -5.369848791818182
  • 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.