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  1. Third-Parties
  2. MatprojStructure
  3. mp-781710

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-781710
  • 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: 24
  • Number of elements: 3
  • Element list: ['Nb', 'N', 'O']
  • Chemical System: N-Nb-O
  • Density: 6.1089499792394
  • Atomic Density: 0.08979305441601755
  • Unit Cell Volume: 267.2812519418964
  • Molar Volume: 6.706688840429681
  • Full Formula: Nb8 N8 O8
  • Reduced Formula: NbNO
  • Formula Anonymous: ABC
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -233.93499381
  • Final energy per atom: -9.74729140875
  • 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.