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  1. Third-Parties
  2. MatprojStructure
  3. mp-19428

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-19428
  • 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: 14
  • Number of elements: 5
  • Element list: ['K', 'Rb', 'Tb', 'V', 'O']
  • Chemical System: K-O-Rb-Tb-V
  • Density: 3.7088489885714204
  • Atomic Density: 0.05659929222006638
  • Unit Cell Volume: 247.3529164563744
  • Molar Volume: 10.639957716405764
  • Full Formula: K2 Rb1 Tb1 V2 O8
  • Reduced Formula: K2RbTbV2O8
  • Formula Anonymous: ABC2D2E8
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1

Thermodynamics:

  • Final energy: -103.82198766
  • Final energy per atom: -7.415856261428572
  • 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.