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: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-14499
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 2
  • Element list: ['Pr', 'Cd']
  • Chemical System: Cd-Pr
  • Density: 7.814159308644072
  • Atomic Density: 0.03860061711757397
  • Unit Cell Volume: 77.7189647217886
  • Molar Volume: 15.601151509202838
  • Full Formula: Pr1 Cd2
  • Reduced Formula: PrCd2
  • Formula Anonymous: AB2
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm