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  1. Third-Parties
  2. MatprojStructure
  3. mp-768846

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-768846
  • 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: 13
  • Number of elements: 3
  • Element list: ['Rb', 'Fe', 'O']
  • Chemical System: Fe-O-Rb
  • Density: 4.778399362629554
  • Atomic Density: 0.07388546189746481
  • Unit Cell Volume: 175.94801015172462
  • Molar Volume: 8.150643719812265
  • Full Formula: Rb2 Fe4 O7
  • Reduced Formula: Rb2Fe4O7
  • Formula Anonymous: A2B4C7
  • Spacegroup Number: 162
  • Spacegroup Symbol: P-31m
  • Crystal System: trigonal
  • Pointgroup: -31m

Thermodynamics:

  • Final energy: -91.89467144
  • Final energy per atom: -7.06882088
  • 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.