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  1. Third-Parties
  2. MatprojStructure
  3. mp-865734

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-865734
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 15
  • Number of elements: 3
  • Element list: ['Li', 'Cu', 'P']
  • Chemical System: Cu-Li-P
  • Density: 3.706913926495848
  • Atomic Density: 0.0705353049226211
  • Unit Cell Volume: 212.65946204465064
  • Molar Volume: 8.537768095858425
  • Full Formula: Li5 Cu4 P6
  • Reduced Formula: Li5(Cu2P3)2
  • Formula Anonymous: A4B5C6
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -65.12404689
  • Final energy per atom: -4.341603126
  • 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.