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  1. Third-Parties
  2. MatprojStructure
  3. mp-1216512

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-1216512
  • 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: 18
  • Number of elements: 3
  • Element list: ['V', 'Ni', 'P']
  • Chemical System: Ni-P-V
  • Density: 6.245660387936874
  • Atomic Density: 0.0825235866198062
  • Unit Cell Volume: 218.1194581729423
  • Molar Volume: 7.297478220068839
  • Full Formula: V9 Ni3 P6
  • Reduced Formula: V3NiP2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -145.3639536
  • Final energy per atom: -8.0757752
  • 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.