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  1. Third-Parties
  2. MatprojStructure
  3. mp-1183294

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-1183294
  • 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: 2
  • Number of elements: 2
  • Element list: ['Ba', 'Dy']
  • Chemical System: Ba-Dy
  • Density: 5.891331301919601
  • Atomic Density: 0.0236659316047017
  • Unit Cell Volume: 84.50966703557366
  • Molar Volume: 25.446455523447828
  • Full Formula: Ba1 Dy1
  • Reduced Formula: BaDy
  • Formula Anonymous: AB
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2

Thermodynamics:

  • Final energy: -5.89873556
  • Final energy per atom: -2.94936778
  • 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.