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  1. Third-Parties
  2. MatprojStructure
  3. mp-569962

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-569962
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 140
  • Number of elements: 4
  • Element list: ['Tb', 'Rb', 'C', 'Br']
  • Chemical System: Br-C-Rb-Tb
  • Density: 5.021193430287004
  • Atomic Density: 0.03181635292168725
  • Unit Cell Volume: 4400.252924796123
  • Molar Volume: 18.92781606623139
  • Full Formula: Rb8 Tb40 C16 Br76
  • Reduced Formula: Rb2Tb10C4Br19
  • Formula Anonymous: A2B4C10D19
  • Spacegroup Number: 60
  • Spacegroup Symbol: Pbcn
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -732.84028448
  • Final energy per atom: -5.234573460571429
  • 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.