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  1. Third-Parties
  2. MatprojStructure
  3. mp-541950

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-541950
  • 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: 20
  • Number of elements: 3
  • Element list: ['Ga', 'N', 'O']
  • Chemical System: Ga-N-O
  • Density: 2.1770920531580487
  • Atomic Density: 0.07208700084550801
  • Unit Cell Volume: 277.4425314608753
  • Molar Volume: 8.353989886340598
  • Full Formula: Ga1 N5 O14
  • Reduced Formula: GaN5O14
  • Formula Anonymous: AB5C14
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -131.68014418
  • Final energy per atom: -6.584007209000001
  • 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.