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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-35128
  • 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: 14
  • Number of elements: 3
  • Element list: ['Ca', 'Si', 'O']
  • Chemical System: Ca-O-Si
  • Density: 3.0770441997711897
  • Atomic Density: 0.0753097021031645
  • Unit Cell Volume: 185.899022423722
  • Molar Volume: 7.99650057272893
  • Full Formula: Ca4 Si2 O8
  • Reduced Formula: Ca2SiO4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm