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-1516368
  • Created at: Sept. 4, 2022, 3:54 p.m.
  • Last updated at: Sept. 4, 2022, 3:54 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 30
  • Number of elements: 2
  • Element list: ['Re', 'Ta']
  • Chemical System: Re-Ta
  • Density: 20.234144626647822
  • Atomic Density: 0.06556291437207099
  • Unit Cell Volume: 457.57575433192824
  • Molar Volume: 9.185285336500172
  • Full Formula: Ta2 Re28
  • Reduced Formula: TaRe14
  • Formula Anonymous: AB14
  • Spacegroup Number: 136
  • Spacegroup Symbol: P4_2/mnm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm