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  1. Third-Parties
  2. MatprojStructure
  3. mp-573324

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-573324
  • 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: 14
  • Number of elements: 5
  • Element list: ['Cs', 'K', 'Ho', 'P', 'O']
  • Chemical System: Cs-Ho-K-O-P
  • Density: 4.099648686008008
  • Atomic Density: 0.06107004760014495
  • Unit Cell Volume: 229.2449498592952
  • Molar Volume: 9.86103826122727
  • Full Formula: Cs1 K2 Ho1 P2 O8
  • Reduced Formula: CsK2Ho(PO4)2
  • Formula Anonymous: ABC2D2E8
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1

Thermodynamics:

  • Final energy: -99.98265829
  • Final energy per atom: -7.141618449285715
  • 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.