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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104972
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 4
  • Element list: ['Ba', 'V', 'Se', 'S']
  • Chemical System: Ba-S-Se-V
  • Density: 5.1643025241812595
  • Atomic Density: 0.0411102035256652
  • Unit Cell Volume: 243.24861329759597
  • Molar Volume: 14.648773889529306
  • Full Formula: Ba2 V2 Se4 S2
  • Reduced Formula: BaVSe2S
  • Formula Anonymous: ABCD2
  • Spacegroup Number: 38
  • Spacegroup Symbol: Amm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2