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  1. Third-Parties
  2. MatprojStructure
  3. mp-1197626

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-1197626
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 68
  • Number of elements: 4
  • Element list: ['Ho', 'H', 'C', 'O']
  • Chemical System: C-H-Ho-O
  • Density: 2.3424219534395982
  • Atomic Density: 0.10516253440248452
  • Unit Cell Volume: 646.6181172445523
  • Molar Volume: 5.72650782354835
  • Full Formula: Ho2 H30 C6 O30
  • Reduced Formula: HoH15(CO5)3
  • Formula Anonymous: AB3C15D15
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -422.09007408
  • Final energy per atom: -6.207206971764706
  • 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.