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  1. Third-Parties
  2. MatprojStructure
  3. mp-623463

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-623463
  • 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: 36
  • Number of elements: 3
  • Element list: ['Tb', 'Mn', 'Ge']
  • Chemical System: Ge-Mn-Tb
  • Density: 6.15928022117756
  • Atomic Density: 0.05123718261513206
  • Unit Cell Volume: 702.6147450458759
  • Molar Volume: 11.753458040882716
  • Full Formula: Tb4 Mn20 Ge12
  • Reduced Formula: TbMn5Ge3
  • Formula Anonymous: AB3C5
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -259.04785661
  • Final energy per atom: -7.195773794722222
  • 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.