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  1. Third-Parties
  2. MatprojStructure
  3. mp-1200718

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-1200718
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 4
  • Element list: ['Cs', 'In', 'Cl', 'O']
  • Chemical System: Cl-Cs-In-O
  • Density: 3.0107178435034254
  • Atomic Density: 0.028433630215913767
  • Unit Cell Volume: 1266.1063580918162
  • Molar Volume: 21.17964084877745
  • Full Formula: Cs8 In4 Cl20 O4
  • Reduced Formula: Cs2InCl5O
  • Formula Anonymous: ABC2D5
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -126.15258524
  • Final energy per atom: -3.5042384788888885
  • 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.