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  1. Third-Parties
  2. MatprojStructure
  3. mp-1540553

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-1540553
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 18
  • Number of elements: 4
  • Element list: ['Rb', 'Ti', 'Te', 'O']
  • Chemical System: O-Rb-Te-Ti
  • Density: 4.884544572165867
  • Atomic Density: 0.06671881786365685
  • Unit Cell Volume: 269.7889527476922
  • Molar Volume: 9.026150271886618
  • Full Formula: Rb2 Ti1 Te3 O12
  • Reduced Formula: Rb2Ti(TeO4)3
  • Formula Anonymous: AB2C3D12
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m

Thermodynamics:

  • Final energy: -114.65113084
  • Final energy per atom: -6.3695072688888885
  • 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.