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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117219
  • 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: 29
  • Number of elements: 4
  • Element list: ['Cu', 'Hg', 'Sb', 'S']
  • Chemical System: Cu-Hg-S-Sb
  • Density: 5.4559147070225915
  • Atomic Density: 0.04910177937395088
  • Unit Cell Volume: 590.6099609780102
  • Molar Volume: 12.264607997474773
  • Full Formula: Cu10 Hg2 Sb4 S13
  • Reduced Formula: Cu10Hg2Sb4S13
  • Formula Anonymous: A2B4C10D13
  • Spacegroup Number: 121
  • Spacegroup Symbol: I-42m
  • Crystal System: tetragonal
  • Pointgroup: -42m