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  1. Third-Parties
  2. MatprojStructure
  3. mp-1233329

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-1233329
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 29
  • Number of elements: 5
  • Element list: ['K', 'Mg', 'Zn', 'P', 'O']
  • Chemical System: K-Mg-O-P-Zn
  • Density: 2.795832084838833
  • Atomic Density: 0.06904744243347427
  • Unit Cell Volume: 420.0010743039596
  • Molar Volume: 8.721743409688495
  • Full Formula: K2 Mg1 Zn2 P6 O18
  • Reduced Formula: K2MgZn2(PO3)6
  • Formula Anonymous: AB2C2D6E18
  • Spacegroup Number: 174
  • Spacegroup Symbol: P-6
  • Crystal System: hexagonal
  • Pointgroup: -6

Thermodynamics:

  • Final energy: -195.7818508
  • Final energy per atom: -6.751098303448276
  • 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.