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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-8678
  • 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: 7
  • Number of elements: 3
  • Element list: ['Ba', 'P', 'Pd']
  • Chemical System: Ba-P-Pd
  • Density: 5.494315409601542
  • Atomic Density: 0.04885706132612481
  • Unit Cell Volume: 143.275092893419
  • Molar Volume: 12.32603966866064
  • Full Formula: Ba1 P4 Pd2
  • Reduced Formula: Ba(P2Pd)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm