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  1. Third-Parties
  2. MatprojStructure
  3. mp-758131

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-758131
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 32
  • Number of elements: 5
  • Element list: ['V', 'P', 'H', 'N', 'O']
  • Chemical System: H-N-O-P-V
  • Density: 2.230579844582939
  • Atomic Density: 0.10910980695422351
  • Unit Cell Volume: 293.2825278796932
  • Molar Volume: 5.519339579187927
  • Full Formula: V2 P2 H14 N4 O10
  • Reduced Formula: VPH7N2O5
  • Formula Anonymous: ABC2D5E7
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -205.82349465
  • Final energy per atom: -6.4319842078125
  • 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.