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  1. Third-Parties
  2. MatprojStructure
  3. mp-1200742

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-1200742
  • 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: 48
  • Number of elements: 3
  • Element list: ['Tm', 'C', 'O']
  • Chemical System: C-O-Tm
  • Density: 4.637994099416372
  • Atomic Density: 0.06841765438033699
  • Unit Cell Volume: 701.5733064037203
  • Molar Volume: 8.802027509628777
  • Full Formula: Tm8 C8 O32
  • Reduced Formula: TmCO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 137
  • Spacegroup Symbol: P4_2/nmc
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -390.01098479
  • Final energy per atom: -8.125228849791666
  • 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.