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  1. Third-Parties
  2. MatprojStructure
  3. mp-1201828

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-1201828
  • 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: 54
  • Number of elements: 4
  • Element list: ['Sn', 'H', 'Se', 'N']
  • Chemical System: H-N-Se-Sn
  • Density: 2.502271472267324
  • Atomic Density: 0.08661027447854182
  • Unit Cell Volume: 623.4826101766806
  • Molar Volume: 6.953148222029962
  • Full Formula: Sn2 H32 Se6 N14
  • Reduced Formula: SnH16Se3N7
  • Formula Anonymous: AB3C7D16
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -271.2157497
  • Final energy per atom: -5.022513883333334
  • 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.