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  1. Third-Parties
  2. MatprojStructure
  3. mp-1197982

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-1197982
  • 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: 5
  • Element list: ['K', 'Li', 'In', 'Mo', 'O']
  • Chemical System: In-K-Li-Mo-O
  • Density: 3.38923529102593
  • Atomic Density: 0.05704863420674623
  • Unit Cell Volume: 666.0983304576001
  • Molar Volume: 10.556152384254377
  • Full Formula: K4 Li2 In2 Mo6 O24
  • Reduced Formula: K2LiIn(MoO4)3
  • Formula Anonymous: ABC2D3E12
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -279.03707430000003
  • Final energy per atom: -7.34308090263158
  • 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.