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  1. Third-Parties
  2. MatprojStructure
  3. mp-1220717

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-1220717
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 21
  • Number of elements: 4
  • Element list: ['Nd', 'In', 'Ni', 'Ge']
  • Chemical System: Ge-In-Nd-Ni
  • Density: 7.732969970597946
  • Atomic Density: 0.04425133822429117
  • Unit Cell Volume: 474.56191931552337
  • Molar Volume: 13.608946083113544
  • Full Formula: Nd7 In6 Ni5 Ge3
  • Reduced Formula: Nd7In6Ni5Ge3
  • Formula Anonymous: A3B5C6D7
  • Spacegroup Number: 174
  • Spacegroup Symbol: P-6
  • Crystal System: hexagonal
  • Pointgroup: -6

Thermodynamics:

  • Final energy: -105.23037752
  • Final energy per atom: -5.010970358095238
  • 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.