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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-108805
  • 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: 10
  • Number of elements: 4
  • Element list: ['Ba', 'Ti', 'V', 'S']
  • Chemical System: Ba-S-Ti-V
  • Density: 4.185122522904489
  • Atomic Density: 0.044540577163637025
  • Unit Cell Volume: 224.51437850167804
  • Molar Volume: 13.52057189981023
  • Full Formula: Ba2 Ti1 V1 S6
  • Reduced Formula: Ba2TiVS6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1