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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111048
  • 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: 4
  • Number of elements: 3
  • Element list: ['Hf', 'Zr', 'Nb']
  • Chemical System: Hf-Nb-Zr
  • Density: 9.338473788278343
  • Atomic Density: 0.049382480762286844
  • Unit Cell Volume: 81.0003859314978
  • Molar Volume: 12.194893142345087
  • Full Formula: Hf1 Zr1 Nb2
  • Reduced Formula: HfZrNb2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 35
  • Spacegroup Symbol: Cmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2