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-105467
  • 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: ['La', 'Al', 'Zn']
  • Chemical System: Al-La-Zn
  • Density: 5.695035335930816
  • Atomic Density: 0.03705690703095028
  • Unit Cell Volume: 107.94209016578642
  • Molar Volume: 16.25106152267444
  • Full Formula: La2 Al1 Zn1
  • Reduced Formula: La2AlZn
  • Formula Anonymous: ABC2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm