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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-23800
  • 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: 12
  • Number of elements: 3
  • Element list: ['Mo', 'P', 'Ru']
  • Chemical System: Mo-P-Ru
  • Density: 9.154579415747826
  • Atomic Density: 0.07254485851402492
  • Unit Cell Volume: 165.4148928787292
  • Molar Volume: 8.30126473930024
  • Full Formula: Mo4 P4 Ru4
  • Reduced Formula: MoPRu
  • Formula Anonymous: ABC
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm