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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-35314
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Pr', 'H', 'Se']
  • Chemical System: H-Pr-Se
  • Density: 6.414034072065794
  • Atomic Density: 0.052463311180875064
  • Unit Cell Volume: 114.36563695558803
  • Molar Volume: 11.478766064226816
  • Full Formula: Pr2 H2 Se2
  • Reduced Formula: PrHSe
  • Formula Anonymous: ABC
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm