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  1. Third-Parties
  2. MatprojStructure
  3. mp-646071

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-646071
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 3
  • Element list: ['Li', 'Yb', 'Ge']
  • Chemical System: Ge-Li-Yb
  • Density: 7.551749563123524
  • Atomic Density: 0.04135752442725644
  • Unit Cell Volume: 870.4582902035212
  • Molar Volume: 14.561173192540373
  • Full Formula: Li4 Yb16 Ge16
  • Reduced Formula: Li(YbGe)4
  • Formula Anonymous: AB4C4
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -127.14957525
  • Final energy per atom: -3.5319326458333333
  • 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.