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  1. Third-Parties
  2. MatprojStructure
  3. mp-1200794

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-1200794
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 92
  • Number of elements: 4
  • Element list: ['Yb', 'H', 'C', 'O']
  • Chemical System: C-H-O-Yb
  • Density: 2.6144384154850675
  • Atomic Density: 0.08960539344181208
  • Unit Cell Volume: 1026.723910985815
  • Molar Volume: 6.720734688711183
  • Full Formula: Yb4 H28 C16 O44
  • Reduced Formula: YbH7C4O11
  • Formula Anonymous: AB4C7D11
  • Spacegroup Number: 86
  • Spacegroup Symbol: P4_2/n
  • Crystal System: tetragonal
  • Pointgroup: 4/m

Thermodynamics:

  • Final energy: -612.32778232
  • Final energy per atom: -6.655736764347826
  • 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.