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  1. Third-Parties
  2. MatprojStructure
  3. mp-1218899

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-1218899
  • 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: 42
  • Number of elements: 5
  • Element list: ['Sr', 'P', 'Cl', 'O', 'F']
  • Chemical System: Cl-F-O-P-Sr
  • Density: 3.969681113510952
  • Atomic Density: 0.06691534568899152
  • Unit Cell Volume: 627.6587166598106
  • Molar Volume: 8.99964081182461
  • Full Formula: Sr10 P6 Cl1 O24 F1
  • Reduced Formula: Sr10P6ClO24F
  • Formula Anonymous: ABC6D10E24
  • Spacegroup Number: 143
  • Spacegroup Symbol: P3
  • Crystal System: trigonal
  • Pointgroup: 3

Thermodynamics:

  • Final energy: -313.50216562
  • Final energy per atom: -7.464337276666667
  • 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.