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: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-325077
  • Created at: Sept. 4, 2022, 2:51 p.m.
  • Last updated at: Sept. 4, 2022, 2:51 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 8
  • Number of elements: 2
  • Element list: ['Cr', 'La']
  • Chemical System: Cr-La
  • Density: 7.070793110817127
  • Atomic Density: 0.03633895874713838
  • Unit Cell Volume: 220.14940096845743
  • Molar Volume: 16.572133510771636
  • Full Formula: La6 Cr2
  • Reduced Formula: La3Cr
  • Formula Anonymous: AB3
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm