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  1. Third-Parties
  2. MatprojStructure
  3. mp-1197782

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-1197782
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 88
  • Number of elements: 5
  • Element list: ['K', 'V', 'Te', 'H', 'O']
  • Chemical System: H-K-O-Te-V
  • Density: 3.5644680662202046
  • Atomic Density: 0.07410968847333882
  • Unit Cell Volume: 1187.4290907545544
  • Molar Volume: 8.125983098912206
  • Full Formula: K6 V10 Te8 H16 O48
  • Reduced Formula: K3V5Te4(HO3)8
  • Formula Anonymous: A3B4C5D8E24
  • Spacegroup Number: 59
  • Spacegroup Symbol: Pmmn1
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -579.1403467
  • Final energy per atom: -6.581140303409091
  • 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.