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  1. Third-Parties
  2. MatprojStructure
  3. mp-720118

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-720118
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 97
  • Number of elements: 6
  • Element list: ['Sr', 'Nd', 'Al', 'Si', 'N', 'O']
  • Chemical System: Al-N-Nd-O-Si-Sr
  • Density: 4.484491483183336
  • Atomic Density: 0.07874183115727573
  • Unit Cell Volume: 1231.873815662937
  • Molar Volume: 7.647956202557216
  • Full Formula: Sr3 Nd10 Al12 Si18 N36 O18
  • Reduced Formula: Sr3Nd10Al12Si18(N2O)18
  • Formula Anonymous: A3B10C12D18E18F36
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -788.8618460299999
  • Final energy per atom: -8.132596350824741
  • 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.