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  1. Third-Parties
  2. MatprojStructure
  3. mp-1046153

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-1046153
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 26
  • Number of elements: 5
  • Element list: ['Sr', 'Mg', 'Cu', 'P', 'O']
  • Chemical System: Cu-Mg-O-P-Sr
  • Density: 3.8576103387301997
  • Atomic Density: 0.08264712631488498
  • Unit Cell Volume: 314.59049042963915
  • Molar Volume: 7.286570058172
  • Full Formula: Sr2 Mg2 Cu2 P4 O16
  • Reduced Formula: SrMgCu(PO4)2
  • Formula Anonymous: ABCD2E8
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -187.14058154
  • Final energy per atom: -7.197714674615384
  • 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.