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-370836
  • Created at: Sept. 4, 2022, 2:52 p.m.
  • Last updated at: Sept. 4, 2022, 2:52 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Np', 'Os', 'Re']
  • Chemical System: Np-Os-Re
  • Density: 20.03548721083979
  • Atomic Density: 0.060052994198121025
  • Unit Cell Volume: 66.60783618554618
  • Molar Volume: 10.028044130709514
  • Full Formula: Np1 Re1 Os2
  • Reduced Formula: NpReOs2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m