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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-91229
  • 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: 18
  • Number of elements: 3
  • Element list: ['K', 'Pd', 'Se']
  • Chemical System: K-Pd-Se
  • Density: 5.181603272101326
  • Atomic Density: 0.03937199455327404
  • Unit Cell Volume: 457.177752974752
  • Molar Volume: 15.295493226413697
  • Full Formula: K4 Pd6 Se8
  • Reduced Formula: K2Pd3Se4
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 70
  • Spacegroup Symbol: Fddd1
  • Crystal System: orthorhombic
  • Pointgroup: mmm