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  1. Third-Parties
  2. MatprojStructure
  3. mp-1233409

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-1233409
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 23
  • Number of elements: 4
  • Element list: ['Er', 'Mg', 'Ta', 'O']
  • Chemical System: Er-Mg-O-Ta
  • Density: 8.895026957617414
  • Atomic Density: 0.07634678114405788
  • Unit Cell Volume: 301.2569705669917
  • Molar Volume: 7.887877746459136
  • Full Formula: Er6 Mg1 Ta2 O14
  • Reduced Formula: Er6MgTa2O14
  • Formula Anonymous: AB2C6D14
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -203.54689220000003
  • Final energy per atom: -8.84986487826087
  • 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.