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  1. Third-Parties
  2. MatprojStructure
  3. mp-1044616

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-1044616
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 45
  • Number of elements: 4
  • Element list: ['Si', 'Sb', 'Mo', 'O']
  • Chemical System: Mo-O-Sb-Si
  • Density: 5.196442196187674
  • Atomic Density: 0.07059105122144856
  • Unit Cell Volume: 637.4745696707671
  • Molar Volume: 8.531025754395081
  • Full Formula: Si2 Sb2 Mo13 O28
  • Reduced Formula: Si2Sb2Mo13O28
  • Formula Anonymous: A2B2C13D28
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -375.6329824099999
  • Final energy per atom: -8.34739960911111
  • 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.