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  1. Third-Parties
  2. MatprojStructure
  3. mp-697339

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-697339
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 56
  • Number of elements: 4
  • Element list: ['Ho', 'H', 'C', 'O']
  • Chemical System: C-H-Ho-O
  • Density: 5.206588913912065
  • Atomic Density: 0.09586556303545903
  • Unit Cell Volume: 584.1513701774908
  • Molar Volume: 6.281860314920921
  • Full Formula: Ho8 H16 C4 O28
  • Reduced Formula: Ho2H4CO7
  • Formula Anonymous: AB2C4D7
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -402.93625454
  • Final energy per atom: -7.195290259642857
  • 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.