Download Simmate

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

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-559795

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-559795
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 32
  • Number of elements: 4
  • Element list: ['Rb', 'Na', 'Zn', 'O']
  • Chemical System: Na-O-Rb-Zn
  • Density: 3.9431339982535203
  • Atomic Density: 0.0447998159442484
  • Unit Cell Volume: 714.2886488601367
  • Molar Volume: 13.442333708456117
  • Full Formula: Rb14 Na2 Zn4 O12
  • Reduced Formula: Rb7NaZn2O6
  • Formula Anonymous: AB2C6D7
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -127.2558023
  • Final energy per atom: -3.976743821875
  • 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.