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  1. Third-Parties
  2. MatprojStructure
  3. mp-1193919

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-1193919
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 26
  • Number of elements: 4
  • Element list: ['Sb', 'Au', 'Xe', 'F']
  • Chemical System: Au-F-Sb-Xe
  • Density: 4.506443237231801
  • Atomic Density: 0.05102800438487877
  • Unit Cell Volume: 509.52413901776316
  • Molar Volume: 11.801638791472225
  • Full Formula: Sb3 Au2 Xe2 F19
  • Reduced Formula: Sb3Au2Xe2F19
  • Formula Anonymous: A2B2C3D19
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -109.90736541
  • Final energy per atom: -4.227206361923077
  • 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.