Download Simmate

You can install Simmate to host your own server and access advanced features

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-732348

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-732348
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 38
  • Number of elements: 5
  • Element list: ['Rb', 'Na', 'Sb', 'O', 'F']
  • Chemical System: F-Na-O-Rb-Sb
  • Density: 3.2814170595348333
  • Atomic Density: 0.05375896548787133
  • Unit Cell Volume: 706.8588402909884
  • Molar Volume: 11.202114299164979
  • Full Formula: Rb4 Na4 Sb4 O6 F20
  • Reduced Formula: Rb2Na2Sb2O3F10
  • Formula Anonymous: A2B2C2D3E10
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -183.52578411
  • Final energy per atom: -4.829625897631579
  • 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.