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  1. Third-Parties
  2. MatprojStructure
  3. mp-780453

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-780453
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 76
  • Number of elements: 3
  • Element list: ['Tb', 'Nb', 'O']
  • Chemical System: Nb-O-Tb
  • Density: 7.541509581576307
  • Atomic Density: 0.07292231852469876
  • Unit Cell Volume: 1042.2049317351152
  • Molar Volume: 8.258295789046127
  • Full Formula: Tb16 Nb16 O44
  • Reduced Formula: Tb4Nb4O11
  • Formula Anonymous: A4B4C11
  • Spacegroup Number: 55
  • Spacegroup Symbol: Pbam
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -701.8855461999999
  • Final energy per atom: -9.235336134210526
  • 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.