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  1. Third-Parties
  2. MatprojStructure
  3. mp-1205864

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-1205864
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Y', 'Cd', 'Cu']
  • Chemical System: Cd-Cu-Y
  • Density: 6.530516993408217
  • Atomic Density: 0.04711994638993916
  • Unit Cell Volume: 212.22435011375893
  • Molar Volume: 12.780449090845783
  • Full Formula: Y4 Cd2 Cu4
  • Reduced Formula: Y2CdCu2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 127
  • Spacegroup Symbol: P4/mbm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -47.11603748
  • Final energy per atom: -4.711603748
  • 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.