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-1004235
  • Created at: Sept. 4, 2022, 3:27 p.m.
  • Last updated at: Sept. 4, 2022, 3:27 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 4
  • Element list: ['Cr', 'Mg', 'Tc', 'Tl']
  • Chemical System: Cr-Mg-Tc-Tl
  • Density: 9.217728926991846
  • Atomic Density: 0.058635065088555954
  • Unit Cell Volume: 68.21856501666434
  • Molar Volume: 10.27054502438911
  • Full Formula: Mg1 Tl1 Cr1 Tc1
  • Reduced Formula: MgTlCrTc
  • Formula Anonymous: ABCD
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m