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  1. Third-Parties
  2. MatprojStructure
  3. mp-1203893

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-1203893
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 132
  • Number of elements: 5
  • Element list: ['Sr', 'P', 'H', 'N', 'O']
  • Chemical System: H-N-O-P-Sr
  • Density: 2.0697926089248138
  • Atomic Density: 0.09991499113481268
  • Unit Cell Volume: 1321.1230717310063
  • Molar Volume: 6.027264469127043
  • Full Formula: Sr4 P12 H60 N16 O40
  • Reduced Formula: SrP3H15(N2O5)2
  • Formula Anonymous: AB3C4D10E15
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -801.1457275199999
  • Final energy per atom: -6.069285814545454
  • 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.