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  1. Third-Parties
  2. MatprojStructure
  3. mp-1220914

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-1220914
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 26
  • Number of elements: 3
  • Element list: ['Nb', 'Ni', 'Te']
  • Chemical System: Nb-Ni-Te
  • Density: 7.501635134087725
  • Atomic Density: 0.04717618152955147
  • Unit Cell Volume: 551.125571358789
  • Molar Volume: 12.76521448906943
  • Full Formula: Nb4 Ni10 Te12
  • Reduced Formula: Nb2Ni5Te6
  • Formula Anonymous: A2B5C6
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -149.84400841
  • Final energy per atom: -5.763231092692307
  • 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.