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  1. Third-Parties
  2. MatprojStructure
  3. mp-676252

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-676252
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 49
  • Number of elements: 3
  • Element list: ['Li', 'Ru', 'O']
  • Chemical System: Li-O-Ru
  • Density: 4.133090343326181
  • Atomic Density: 0.0785250461587775
  • Unit Cell Volume: 624.0047271149906
  • Molar Volume: 7.669070003248698
  • Full Formula: Li9 Ru10 O30
  • Reduced Formula: Li9(RuO3)10
  • Formula Anonymous: A9B10C30
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -335.13324912
  • Final energy per atom: -6.83945406367347
  • 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.