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  1. Third-Parties
  2. MatprojStructure
  3. mp-26863

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-26863
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 26
  • Number of elements: 4
  • Element list: ['Li', 'Mo', 'P', 'O']
  • Chemical System: Li-Mo-O-P
  • Density: 3.258875991390069
  • Atomic Density: 0.08511019105174285
  • Unit Cell Volume: 305.48633105750247
  • Molar Volume: 7.075698791862459
  • Full Formula: Li4 Mo2 P4 O16
  • Reduced Formula: Li2Mo(PO4)2
  • Formula Anonymous: AB2C2D8
  • Spacegroup Number: 9
  • Spacegroup Symbol: C1c1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -196.17821313
  • Final energy per atom: -7.5453158896153845
  • 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.