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  1. Third-Parties
  2. MatprojStructure
  3. mp-1079421

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-1079421
  • 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: 8
  • Number of elements: 2
  • Element list: ['U', 'Hg']
  • Chemical System: Hg-U
  • Density: 13.870478600234428
  • Atomic Density: 0.039785702778797685
  • Unit Cell Volume: 201.07725743789808
  • Molar Volume: 15.13644434907224
  • Full Formula: U2 Hg6
  • Reduced Formula: UHg3
  • Formula Anonymous: AB3
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -22.98904788
  • Final energy per atom: -2.873630985
  • 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.