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  1. Third-Parties
  2. MatprojStructure
  3. mp-1246952

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-1246952
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Ge', 'Pb', 'N']
  • Chemical System: Ge-N-Pb
  • Density: 9.022726532287878
  • Atomic Density: 0.0706000053729492
  • Unit Cell Volume: 113.314438968375
  • Molar Volume: 8.529943770099793
  • Full Formula: Ge2 Pb2 N4
  • Reduced Formula: GePbN2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -48.05267044
  • Final energy per atom: -6.006583805
  • 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.