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  1. Third-Parties
  2. MatprojStructure
  3. mp-1178916

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-1178916
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 88
  • Number of elements: 4
  • Element list: ['V', 'P', 'H', 'O']
  • Chemical System: H-O-P-V
  • Density: 1.53483219080581
  • Atomic Density: 0.0858007855225779
  • Unit Cell Volume: 1025.6316357015564
  • Molar Volume: 7.018747816027061
  • Full Formula: V4 P4 H44 O36
  • Reduced Formula: VPH11O9
  • Formula Anonymous: ABC9D11
  • Spacegroup Number: 76
  • Spacegroup Symbol: P4_1
  • Crystal System: tetragonal
  • Pointgroup: 4

Thermodynamics:

  • Final energy: -478.64077082000006
  • Final energy per atom: -5.439099668409091
  • 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.