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  1. Third-Parties
  2. MatprojStructure
  3. mp-1233970

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-1233970
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 17
  • Number of elements: 5
  • Element list: ['Mg', 'Ti', 'Zn', 'P', 'O']
  • Chemical System: Mg-O-P-Ti-Zn
  • Density: 3.385565474427548
  • Atomic Density: 0.07330860055437885
  • Unit Cell Volume: 231.89639239381933
  • Molar Volume: 8.214780686657491
  • Full Formula: Mg1 Ti2 Zn2 P2 O10
  • Reduced Formula: MgTi2Zn2(PO5)2
  • Formula Anonymous: AB2C2D2E10
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -122.54700621
  • Final energy per atom: -7.208647424117648
  • 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.