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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112379
  • 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: 28
  • Number of elements: 6
  • Element list: ['Ba', 'Sr', 'Ca', 'Mg', 'Si', 'O']
  • Chemical System: Ba-Ca-Mg-O-Si-Sr
  • Density: 4.49953026403564
  • Atomic Density: 0.07628801267924634
  • Unit Cell Volume: 367.030140341003
  • Molar Volume: 7.89395417248598
  • Full Formula: Ba2 Sr3 Ca1 Mg2 Si4 O16
  • Reduced Formula: Ba2Sr3CaMg2(SiO4)4
  • Formula Anonymous: AB2C2D3E4F16
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1