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  1. Third-Parties
  2. MatprojStructure
  3. mp-1334103

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-1334103
  • 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: 86
  • Number of elements: 5
  • Element list: ['Li', 'Nd', 'Sb', 'Te', 'O']
  • Chemical System: Li-Nd-O-Sb-Te
  • Density: 5.650256075629067
  • Atomic Density: 0.08107027221154126
  • Unit Cell Volume: 1060.8080823460828
  • Molar Volume: 7.428297199109049
  • Full Formula: Li18 Nd12 Sb6 Te2 O48
  • Reduced Formula: Li9Nd6Sb3TeO24
  • Formula Anonymous: AB3C6D9E24
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -184.92646033
  • Final energy per atom: -2.150307678255814
  • 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.