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  1. Third-Parties
  2. MatprojStructure
  3. mp-569471

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-569471
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['U', 'B', 'C']
  • Chemical System: B-C-U
  • Density: 10.437593754809143
  • Atomic Density: 0.09255140438706744
  • Unit Cell Volume: 86.43845064243963
  • Molar Volume: 6.506806460563548
  • Full Formula: U2 B4 C2
  • Reduced Formula: UB2C
  • Formula Anonymous: ABC2
  • Spacegroup Number: 51
  • Spacegroup Symbol: Pmma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -70.98630484
  • Final energy per atom: -8.873288105
  • 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.