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  1. Third-Parties
  2. MatprojStructure
  3. mp-775210

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-775210
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 34
  • Number of elements: 4
  • Element list: ['Sb', 'P', 'W', 'O']
  • Chemical System: O-P-Sb-W
  • Density: 3.602927002745775
  • Atomic Density: 0.0659288213435944
  • Unit Cell Volume: 515.7076875803031
  • Molar Volume: 9.134306722419673
  • Full Formula: Sb3 P6 W1 O24
  • Reduced Formula: Sb3P6WO24
  • Formula Anonymous: AB3C6D24
  • Spacegroup Number: 146
  • Spacegroup Symbol: R3H
  • Crystal System: trigonal
  • Pointgroup: 3

Thermodynamics:

  • Final energy: -256.27932666
  • Final energy per atom: -7.537627254705882
  • 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.