Download Simmate

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

learn more

Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-116225
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Na', 'La', 'O']
  • Chemical System: La-Na-O
  • Density: 5.257826047046942
  • Atomic Density: 0.06532097361101148
  • Unit Cell Volume: 61.23607440115835
  • Molar Volume: 9.219306490840207
  • Full Formula: Na1 La1 O2
  • Reduced Formula: NaLaO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm