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  1. Third-Parties
  2. MatprojStructure
  3. mp-1202012

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-1202012
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 180
  • Number of elements: 4
  • Element list: ['Na', 'Sn', 'S', 'O']
  • Chemical System: Na-O-S-Sn
  • Density: 2.3856765741675483
  • Atomic Density: 0.06218827941332833
  • Unit Cell Volume: 2894.436085032158
  • Molar Volume: 9.683723069381658
  • Full Formula: Na12 Sn6 S36 O126
  • Reduced Formula: Na2Sn(S2O7)3
  • Formula Anonymous: AB2C6D21
  • Spacegroup Number: 147
  • Spacegroup Symbol: P-3
  • Crystal System: trigonal
  • Pointgroup: -3

Thermodynamics:

  • Final energy: -1149.4796100899998
  • Final energy per atom: -6.385997833833333
  • 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.