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  1. Third-Parties
  2. MatprojStructure
  3. mp-764234

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-764234
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 34
  • Number of elements: 4
  • Element list: ['Li', 'Mn', 'Nb', 'O']
  • Chemical System: Li-Mn-Nb-O
  • Density: 3.656946329646145
  • Atomic Density: 0.1074506180586707
  • Unit Cell Volume: 316.42442467325
  • Molar Volume: 5.604565956718612
  • Full Formula: Li13 Mn3 Nb2 O16
  • Reduced Formula: Li13Mn3Nb2O16
  • Formula Anonymous: A2B3C13D16
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -230.56928021
  • Final energy per atom: -6.781449417941176
  • 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.