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  1. Third-Parties
  2. MatprojStructure
  3. mp-1182726

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-1182726
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 38
  • Number of elements: 3
  • Element list: ['K', 'Mo', 'O']
  • Chemical System: K-Mo-O
  • Density: 2.1833005991443657
  • Atomic Density: 0.048976788007253365
  • Unit Cell Volume: 775.8777483401377
  • Molar Volume: 12.295907929095172
  • Full Formula: K4 Mo4 O30
  • Reduced Formula: K2Mo2O15
  • Formula Anonymous: A2B2C15
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -233.96898047
  • Final energy per atom: -6.157078433421052
  • 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.