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  1. Third-Parties
  2. MatprojStructure
  3. mp-720658

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-720658
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 55
  • Number of elements: 5
  • Element list: ['Cs', 'Mg', 'In', 'P', 'O']
  • Chemical System: Cs-In-Mg-O-P
  • Density: 3.068634740162651
  • Atomic Density: 0.06625237748771304
  • Unit Cell Volume: 830.158887659543
  • Molar Volume: 9.089697590274172
  • Full Formula: Cs3 Mg3 In1 P12 O36
  • Reduced Formula: Cs3Mg3In(PO3)12
  • Formula Anonymous: AB3C3D12E36
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -404.42269092
  • Final energy per atom: -7.353139834909091
  • 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.