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  1. Third-Parties
  2. MatprojStructure
  3. mp-1219648

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-1219648
  • 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: 43
  • Number of elements: 3
  • Element list: ['Re', 'Pb', 'O']
  • Chemical System: O-Pb-Re
  • Density: 9.968546016388505
  • Atomic Density: 0.07212077419542856
  • Unit Cell Volume: 596.2221077034084
  • Molar Volume: 8.350077806543734
  • Full Formula: Re8 Pb8 O27
  • Reduced Formula: Re8Pb8O27
  • Formula Anonymous: A8B8C27
  • Spacegroup Number: 115
  • Spacegroup Symbol: P-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2

Thermodynamics:

  • Final energy: -338.68188407
  • Final energy per atom: -7.876322885348838
  • 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.