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  1. Third-Parties
  2. MatprojStructure
  3. mp-1187769

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-1187769
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 3
  • Number of elements: 1
  • Element list: ['Xe']
  • Chemical System: Xe
  • Density: 2.7706304386431087
  • Atomic Density: 0.012708313848579412
  • Unit Cell Volume: 236.06593571304916
  • Molar Volume: 47.387409783503095
  • Full Formula: Xe3
  • Reduced Formula: Xe
  • Formula Anonymous: A
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m

Thermodynamics:

  • Final energy: -0.1020993
  • Final energy per atom: -0.034033100000000004
  • 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.