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  1. Third-Parties
  2. MatprojStructure
  3. mp-1195064

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-1195064
  • 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: 148
  • Number of elements: 5
  • Element list: ['Sn', 'H', 'S', 'N', 'O']
  • Chemical System: H-N-O-S-Sn
  • Density: 2.0398188839997986
  • Atomic Density: 0.08174512871756597
  • Unit Cell Volume: 1810.5054371049846
  • Molar Volume: 7.366972019588881
  • Full Formula: Sn8 H88 S24 N16 O12
  • Reduced Formula: Sn2H22S6N4O3
  • Formula Anonymous: A2B3C4D6E22
  • Spacegroup Number: 92
  • Spacegroup Symbol: P4_12_12
  • Crystal System: tetragonal
  • Pointgroup: 422

Thermodynamics:

  • Final energy: -727.66535125
  • Final energy per atom: -4.916657778716216
  • 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.