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  1. Third-Parties
  2. MatprojStructure
  3. mp-1408232

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-1408232
  • 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: 34
  • Number of elements: 6
  • Element list: ['Sr', 'Fe', 'B', 'P', 'H', 'O']
  • Chemical System: B-Fe-H-O-P-Sr
  • Density: 3.4200978287403383
  • Atomic Density: 0.09257174949596987
  • Unit Cell Volume: 367.28267732997955
  • Molar Volume: 6.505376416443523
  • Full Formula: Sr2 Fe2 B2 P4 H4 O20
  • Reduced Formula: SrFeBP2(HO5)2
  • Formula Anonymous: ABCD2E2F10
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -130.9421725
  • Final energy per atom: -3.851240367647059
  • 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.