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  1. Third-Parties
  2. MatprojStructure
  3. mp-1192852

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-1192852
  • Created at: Sept. 4, 2022, 2:42 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: ['S', 'N', 'Cl', 'O']
  • Chemical System: Cl-N-O-S
  • Density: 1.9546516522262671
  • Atomic Density: 0.05662246386552929
  • Unit Cell Volume: 494.503384142665
  • Molar Volume: 10.635603520012433
  • Full Formula: S4 N4 Cl4 O16
  • Reduced Formula: SNClO4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -166.85347771000002
  • Final energy per atom: -5.959052775357144
  • 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.