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  1. Third-Parties
  2. MatprojStructure
  3. mp-1192665

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-1192665
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 26
  • Number of elements: 3
  • Element list: ['Mg', 'Cl', 'O']
  • Chemical System: Cl-Mg-O
  • Density: 1.6229168429199134
  • Atomic Density: 0.04978532464168344
  • Unit Cell Volume: 522.2422508465706
  • Molar Volume: 12.096216713143376
  • Full Formula: Mg2 Cl4 O20
  • Reduced Formula: Mg(ClO5)2
  • Formula Anonymous: AB2C10
  • Spacegroup Number: 105
  • Spacegroup Symbol: P4_2mc
  • Crystal System: tetragonal
  • Pointgroup: 4mm

Thermodynamics:

  • Final energy: -104.89489199
  • Final energy per atom: -4.034418922692308
  • 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.