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  1. Third-Parties
  2. MatprojStructure
  3. mp-28454

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-28454
  • 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: 46
  • Number of elements: 3
  • Element list: ['Sm', 'Mo', 'O']
  • Chemical System: Mo-O-Sm
  • Density: 6.029680940772012
  • Atomic Density: 0.07314014199518022
  • Unit Cell Volume: 628.929596595961
  • Molar Volume: 8.23370121484977
  • Full Formula: Sm2 Mo16 O28
  • Reduced Formula: Sm(Mo4O7)2
  • Formula Anonymous: AB8C14
  • Spacegroup Number: 41
  • Spacegroup Symbol: Aea2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -406.74243943
  • Final energy per atom: -8.842226944130434
  • 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.