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  1. Third-Parties
  2. MatprojStructure
  3. mp-1204000

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-1204000
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 56
  • Number of elements: 5
  • Element list: ['Yb', 'Cu', 'Te', 'Cl', 'O']
  • Chemical System: Cl-Cu-O-Te-Yb
  • Density: 5.0969831162151245
  • Atomic Density: 0.052893685573773976
  • Unit Cell Volume: 1058.7275095794462
  • Molar Volume: 11.385368016377987
  • Full Formula: Yb6 Cu6 Te8 Cl12 O24
  • Reduced Formula: Yb3Cu3Te4(ClO2)6
  • Formula Anonymous: A3B3C4D6E12
  • Spacegroup Number: 13
  • Spacegroup Symbol: P12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -301.40701581
  • Final energy per atom: -5.382268139464286
  • 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.