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  1. Third-Parties
  2. MatprojStructure
  3. mp-1199670

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-1199670
  • 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: 52
  • Number of elements: 4
  • Element list: ['Rb', 'Er', 'Mo', 'O']
  • Chemical System: Er-Mo-O-Rb
  • Density: 4.137158000478173
  • Atomic Density: 0.05247936835986426
  • Unit Cell Volume: 990.8655844221083
  • Molar Volume: 11.475253891595385
  • Full Formula: Rb10 Er2 Mo8 O32
  • Reduced Formula: Rb5Er(MoO4)4
  • Formula Anonymous: AB4C5D16
  • Spacegroup Number: 13
  • Spacegroup Symbol: P12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -387.06991477
  • Final energy per atom: -7.443652207115385
  • 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.