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  1. Third-Parties
  2. MatprojStructure
  3. mp-1199963

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-1199963
  • 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: 42
  • Number of elements: 4
  • Element list: ['U', 'Cu', 'Se', 'O']
  • Chemical System: Cu-O-Se-U
  • Density: 4.595625074715827
  • Atomic Density: 0.0664877275759553
  • Unit Cell Volume: 631.6955253436715
  • Molar Volume: 9.057522312099374
  • Full Formula: U2 Cu8 Se4 O28
  • Reduced Formula: UCu4(SeO7)2
  • Formula Anonymous: AB2C4D14
  • Spacegroup Number: 31
  • Spacegroup Symbol: Pmn2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -265.9572136
  • Final energy per atom: -6.332314609523809
  • 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.