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-1228591
  • Created at: Sept. 4, 2022, 3:39 p.m.
  • Last updated at: Sept. 4, 2022, 3:39 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 2
  • Number of elements: 2
  • Element list: ['C', 'Cr']
  • Chemical System: C-Cr
  • Density: 6.419402190822325
  • Atomic Density: 0.12079511427393334
  • Unit Cell Volume: 16.55696103291476
  • Molar Volume: 4.985417494902384
  • Full Formula: Cr1 C1
  • Reduced Formula: CrC
  • Formula Anonymous: AB
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2