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  1. Third-Parties
  2. MatprojStructure
  3. mp-28025

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-28025
  • 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: 64
  • Number of elements: 3
  • Element list: ['Sn', 'S', 'O']
  • Chemical System: O-S-Sn
  • Density: 4.0383493185904396
  • Atomic Density: 0.05566983831615022
  • Unit Cell Volume: 1149.635097492876
  • Molar Volume: 10.817600593341284
  • Full Formula: Sn16 S8 O40
  • Reduced Formula: Sn2SO5
  • Formula Anonymous: AB2C5
  • Spacegroup Number: 114
  • Spacegroup Symbol: P-42_1c
  • Crystal System: tetragonal
  • Pointgroup: -42m

Thermodynamics:

  • Final energy: -411.05318509
  • Final energy per atom: -6.42270601703125
  • 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.