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  1. Third-Parties
  2. MatprojStructure
  3. mp-1198560

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-1198560
  • 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: 32
  • Number of elements: 3
  • Element list: ['Li', 'Al', 'P']
  • Chemical System: Al-Li-P
  • Density: 2.2756986336381257
  • Atomic Density: 0.057179799959135406
  • Unit Cell Volume: 559.6381943075944
  • Molar Volume: 10.531937439976764
  • Full Formula: Li8 Al8 P16
  • Reduced Formula: LiAlP2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 73
  • Spacegroup Symbol: Ibca
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -139.52192007
  • Final energy per atom: -4.3600600021875
  • 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.