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  1. Third-Parties
  2. MatprojStructure
  3. mp-1178881

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-1178881
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 5
  • Element list: ['V', 'Co', 'P', 'N', 'O']
  • Chemical System: Co-N-O-P-V
  • Density: 3.2871079334756934
  • Atomic Density: 0.08158298137884167
  • Unit Cell Volume: 441.2685022238781
  • Molar Volume: 7.381613981518242
  • Full Formula: V2 Co4 P4 N2 O24
  • Reduced Formula: VCo2P2NO12
  • Formula Anonymous: ABC2D2E12
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -254.46060973
  • Final energy per atom: -7.068350270277778
  • 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.