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  1. Third-Parties
  2. MatprojStructure
  3. mp-697873

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-697873
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 28
  • Number of elements: 4
  • Element list: ['Sn', 'H', 'C', 'O']
  • Chemical System: C-H-O-Sn
  • Density: 3.424777032712109
  • Atomic Density: 0.07529637940913594
  • Unit Cell Volume: 371.86382957216495
  • Molar Volume: 7.997915447272243
  • Full Formula: Sn4 H4 C8 O12
  • Reduced Formula: SnHC2O3
  • Formula Anonymous: ABC2D3
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -195.3788352
  • Final energy per atom: -6.977815542857143
  • 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.