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  1. Third-Parties
  2. MatprojStructure
  3. mp-686484

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-686484
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 184
  • Number of elements: 5
  • Element list: ['Li', 'Ca', 'Mg', 'P', 'O']
  • Chemical System: Ca-Li-Mg-O-P
  • Density: 2.9945347040132932
  • Atomic Density: 0.0784994911762178
  • Unit Cell Volume: 2343.964237767501
  • Molar Volume: 7.671566617522826
  • Full Formula: Li4 Ca36 Mg4 P28 O112
  • Reduced Formula: LiCa9Mg(PO4)7
  • Formula Anonymous: ABC7D9E28
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -1388.71649575
  • Final energy per atom: -7.547372259510869
  • 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.