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  1. Third-Parties
  2. MatprojStructure
  3. mp-1102097

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-1102097
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 11
  • Number of elements: 3
  • Element list: ['Tb', 'Ni', 'B']
  • Chemical System: B-Ni-Tb
  • Density: 7.928002183040541
  • Atomic Density: 0.09398387789766233
  • Unit Cell Volume: 117.04135055990922
  • Molar Volume: 6.407631707384347
  • Full Formula: Tb2 Ni3 B6
  • Reduced Formula: Tb2(NiB2)3
  • Formula Anonymous: A2B3C6
  • Spacegroup Number: 65
  • Spacegroup Symbol: Cmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -72.82373875
  • Final energy per atom: -6.620339886363637
  • 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.