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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-34458
  • 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: 16
  • Number of elements: 4
  • Element list: ['Cu', 'Hg', 'S', 'Br']
  • Chemical System: Br-Cu-Hg-S
  • Density: 6.370738869160806
  • Atomic Density: 0.04080295261009333
  • Unit Cell Volume: 392.12848523227007
  • Molar Volume: 14.759080837964449
  • Full Formula: Cu4 Hg4 S4 Br4
  • Reduced Formula: CuHgSBr
  • Formula Anonymous: ABCD
  • Spacegroup Number: 51
  • Spacegroup Symbol: Pmma
  • Crystal System: orthorhombic
  • Pointgroup: mmm