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  1. Third-Parties
  2. MatprojStructure
  3. mp-727459

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-727459
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 100
  • Number of elements: 3
  • Element list: ['Rb', 'P', 'O']
  • Chemical System: O-P-Rb
  • Density: 2.7423328765378963
  • Atomic Density: 0.051146600675658814
  • Unit Cell Volume: 1955.1641493076004
  • Molar Volume: 11.774273716036028
  • Full Formula: Rb20 P16 O64
  • Reduced Formula: Rb5(PO4)4
  • Formula Anonymous: A4B5C16
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -635.65374259
  • Final energy per atom: -6.3565374259
  • 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.