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  1. Third-Parties
  2. MatprojStructure
  3. mp-15704

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-15704
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Be', 'Si', 'N']
  • Chemical System: Be-N-Si
  • Density: 3.1928535219439826
  • Atomic Density: 0.11812313818930631
  • Unit Cell Volume: 67.72593517773845
  • Molar Volume: 5.098188934287206
  • Full Formula: Be2 Si2 N4
  • Reduced Formula: BeSiN2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 122
  • Spacegroup Symbol: I-42d
  • Crystal System: tetragonal
  • Pointgroup: -42m

Thermodynamics:

  • Final energy: -62.87658524
  • Final energy per atom: -7.859573155
  • 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.