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  1. Third-Parties
  2. MatprojStructure
  3. mp-1202787

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-1202787
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 56
  • Number of elements: 3
  • Element list: ['Ho', 'Cr', 'S']
  • Chemical System: Cr-Ho-S
  • Density: 5.71955309326975
  • Atomic Density: 0.04726519595633512
  • Unit Cell Volume: 1184.8041432375385
  • Molar Volume: 12.741173792156532
  • Full Formula: Ho16 Cr8 S32
  • Reduced Formula: Ho2CrS4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 29
  • Spacegroup Symbol: Pca2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -388.00710071
  • Final energy per atom: -6.928698226964285
  • 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.