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  1. Third-Parties
  2. MatprojStructure
  3. mp-1211605

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-1211605
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 48
  • Number of elements: 5
  • Element list: ['K', 'Rb', 'Mn', 'V', 'O']
  • Chemical System: K-Mn-O-Rb-V
  • Density: 2.9285057738674727
  • Atomic Density: 0.053797575772779584
  • Unit Cell Volume: 892.2335125793339
  • Molar Volume: 11.194074590712459
  • Full Formula: K4 Rb4 Mn4 V8 O28
  • Reduced Formula: KRbMnV2O7
  • Formula Anonymous: ABCD2E7
  • Spacegroup Number: 136
  • Spacegroup Symbol: P4_2/mnm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -370.93717164
  • Final energy per atom: -7.7278577424999995
  • 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.