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  1. Third-Parties
  2. MatprojStructure
  3. mp-973809

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-973809
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 28
  • Number of elements: 2
  • Element list: ['Nd', 'Be']
  • Chemical System: Be-Nd
  • Density: 3.175610800387192
  • Atomic Density: 0.10242359547317345
  • Unit Cell Volume: 273.37450780405084
  • Molar Volume: 5.87964202211326
  • Full Formula: Nd2 Be26
  • Reduced Formula: NdBe13
  • Formula Anonymous: AB13
  • Spacegroup Number: 226
  • Spacegroup Symbol: Fm-3c
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -111.30032371
  • Final energy per atom: -3.9750115610714287
  • 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.