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  1. Third-Parties
  2. MatprojStructure
  3. mp-1237649

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-1237649
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 65
  • Number of elements: 3
  • Element list: ['Y', 'V', 'O']
  • Chemical System: O-V-Y
  • Density: 2.59945688591471
  • Atomic Density: 0.06628013112055436
  • Unit Cell Volume: 980.686050270088
  • Molar Volume: 9.085891440146009
  • Full Formula: Y2 V10 O53
  • Reduced Formula: Y2V10O53
  • Formula Anonymous: A2B10C53
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -436.16381214
  • Final energy per atom: -6.710212494461539
  • 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.