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  1. Third-Parties
  2. MatprojStructure
  3. mp-1200333

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-1200333
  • 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: 72
  • Number of elements: 3
  • Element list: ['La', 'Co', 'Cl']
  • Chemical System: Cl-Co-La
  • Density: 4.434999888989673
  • Atomic Density: 0.037489597557306145
  • Unit Cell Volume: 1920.5327528507519
  • Molar Volume: 16.063498016468778
  • Full Formula: La24 Co4 Cl44
  • Reduced Formula: La6CoCl11
  • Formula Anonymous: AB6C11
  • Spacegroup Number: 86
  • Spacegroup Symbol: P4_2/n
  • Crystal System: tetragonal
  • Pointgroup: 4/m

Thermodynamics:

  • Final energy: -399.40234298
  • Final energy per atom: -5.547254763611111
  • 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.