Download Simmate

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

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-720104

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-720104
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 50
  • Number of elements: 5
  • Element list: ['Na', 'Al', 'Ge', 'N', 'O']
  • Chemical System: Al-Ge-N-Na-O
  • Density: 2.6857039362653423
  • Atomic Density: 0.06430153259414897
  • Unit Cell Volume: 777.5864428548578
  • Molar Volume: 9.3654700238793
  • Full Formula: Na8 Al6 Ge6 N2 O28
  • Reduced Formula: Na4Al3Ge3NO14
  • Formula Anonymous: AB3C3D4E14
  • Spacegroup Number: 9
  • Spacegroup Symbol: C1c1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -337.40762679
  • Final energy per atom: -6.7481525358
  • 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.