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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-89142
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Ba', 'V', 'Se']
  • Chemical System: Ba-Se-V
  • Density: 5.5971475413220695
  • Atomic Density: 0.039641219903137105
  • Unit Cell Volume: 252.26267063513413
  • Molar Volume: 15.191613110582962
  • Full Formula: Ba2 V2 Se6
  • Reduced Formula: BaVSe3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm