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  1. Third-Parties
  2. MatprojStructure
  3. mp-1208570

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-1208570
  • 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: 116
  • Number of elements: 4
  • Element list: ['V', 'Fe', 'Mo', 'O']
  • Chemical System: Fe-Mo-O-V
  • Density: 3.7842758404798946
  • Atomic Density: 0.0708299595661499
  • Unit Cell Volume: 1637.7250631022125
  • Molar Volume: 8.50225073808742
  • Full Formula: V8 Fe16 Mo12 O80
  • Reduced Formula: V2Fe4Mo3O20
  • Formula Anonymous: A2B3C4D20
  • Spacegroup Number: 91
  • Spacegroup Symbol: P4_122
  • Crystal System: tetragonal
  • Pointgroup: 422

Thermodynamics:

  • Final energy: -961.24401846
  • Final energy per atom: -8.286586366034483
  • 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.