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  1. Third-Parties
  2. MatprojStructure
  3. mp-1201281

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-1201281
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 4
  • Element list: ['Cs', 'Np', 'Mo', 'O']
  • Chemical System: Cs-Mo-Np-O
  • Density: 4.698835106459909
  • Atomic Density: 0.04897027745226996
  • Unit Cell Volume: 816.8220006306263
  • Molar Volume: 12.2975426591561
  • Full Formula: Cs4 Np4 Mo4 O28
  • Reduced Formula: CsNpMoO7
  • Formula Anonymous: ABCD7
  • Spacegroup Number: 52
  • Spacegroup Symbol: Pnna
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -337.41857436
  • Final energy per atom: -8.435464359
  • 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.