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  1. Third-Parties
  2. MatprojStructure
  3. mp-1201685

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-1201685
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 58
  • Number of elements: 4
  • Element list: ['Er', 'H', 'S', 'O']
  • Chemical System: Er-H-O-S
  • Density: 3.7771955951423863
  • Atomic Density: 0.0949465618247839
  • Unit Cell Volume: 610.8699344693939
  • Molar Volume: 6.342663330045976
  • Full Formula: Er4 H16 S6 O32
  • Reduced Formula: Er2H8S3O16
  • Formula Anonymous: A2B3C8D16
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -375.8137194
  • Final energy per atom: -6.479546886206897
  • 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.