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  1. Third-Parties
  2. MatprojStructure
  3. mp-25466

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-25466
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 22
  • Number of elements: 5
  • Element list: ['Li', 'Cu', 'P', 'C', 'O']
  • Chemical System: C-Cu-Li-O-P
  • Density: 2.7652010466099597
  • Atomic Density: 0.08124316040150052
  • Unit Cell Volume: 270.79202595365393
  • Molar Volume: 7.412489531720351
  • Full Formula: Li2 Cu2 P2 C2 O14
  • Reduced Formula: LiCuPCO7
  • Formula Anonymous: ABCDE7
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -151.1203641
  • Final energy per atom: -6.869107459090909
  • 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.