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  1. Third-Parties
  2. MatprojStructure
  3. mp-1233154

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-1233154
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 21
  • Number of elements: 5
  • Element list: ['K', 'Nd', 'Mg', 'Nb', 'O']
  • Chemical System: K-Mg-Nb-Nd-O
  • Density: 5.459795228867153
  • Atomic Density: 0.06530681789666895
  • Unit Cell Volume: 321.5590757036583
  • Molar Volume: 9.221304840680602
  • Full Formula: K2 Nd4 Mg1 Nb2 O12
  • Reduced Formula: K2Nd4MgNb2O12
  • Formula Anonymous: AB2C2D4E12
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -166.59169484
  • Final energy per atom: -7.932937849523809
  • 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.