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  1. Third-Parties
  2. MatprojStructure
  3. mp-1225750

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-1225750
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 5
  • Number of elements: 2
  • Element list: ['Er', 'Si']
  • Chemical System: Er-Si
  • Density: 6.727369497293487
  • Atomic Density: 0.04837109956698928
  • Unit Cell Volume: 103.36750755635573
  • Molar Volume: 12.449873610294757
  • Full Formula: Er2 Si3
  • Reduced Formula: Er2Si3
  • Formula Anonymous: A2B3
  • Spacegroup Number: 25
  • Spacegroup Symbol: Pmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -28.20806826
  • Final energy per atom: -5.641613652
  • 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.