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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-75814
  • 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: 4
  • Number of elements: 3
  • Element list: ['As', 'P', 'Cl']
  • Chemical System: As-Cl-P
  • Density: 3.610851350870313
  • Atomic Density: 0.05047536462791463
  • Unit Cell Volume: 79.24657958365418
  • Molar Volume: 11.930851425032692
  • Full Formula: As1 P2 Cl1
  • Reduced Formula: AsP2Cl
  • Formula Anonymous: ABC2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm