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  1. Third-Parties
  2. MatprojStructure
  3. mp-1233513

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-1233513
  • 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: 25
  • Number of elements: 5
  • Element list: ['K', 'Gd', 'Mg', 'Mo', 'O']
  • Chemical System: Gd-K-Mg-Mo-O
  • Density: 5.095854955259982
  • Atomic Density: 0.07259971082080804
  • Unit Cell Volume: 344.3539887053471
  • Molar Volume: 8.294992765004201
  • Full Formula: K2 Gd2 Mg1 Mo4 O16
  • Reduced Formula: K2Gd2Mg(MoO4)4
  • Formula Anonymous: AB2C2D4E16
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -216.44408373000005
  • Final energy per atom: -8.657763349200001
  • 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.