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  1. Third-Parties
  2. MatprojStructure
  3. mp-676498

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-676498
  • 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: 14
  • Number of elements: 3
  • Element list: ['Gd', 'Pb', 'S']
  • Chemical System: Gd-Pb-S
  • Density: 6.8409794869881395
  • Atomic Density: 0.044369098090353956
  • Unit Cell Volume: 315.53492413774495
  • Molar Volume: 13.572826627524444
  • Full Formula: Gd4 Pb2 S8
  • Reduced Formula: Gd2PbS4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 122
  • Spacegroup Symbol: I-42d
  • Crystal System: tetragonal
  • Pointgroup: -42m

Thermodynamics:

  • Final energy: -123.02106842000002
  • Final energy per atom: -8.787219172857144
  • 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.