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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-91944
  • 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: 8
  • Number of elements: 3
  • Element list: ['Ca', 'Zn', 'Se']
  • Chemical System: Ca-Se-Zn
  • Density: 4.391140780129291
  • Atomic Density: 0.0383146715215073
  • Unit Cell Volume: 208.7973009375621
  • Molar Volume: 15.717584206925986
  • Full Formula: Ca1 Zn3 Se4
  • Reduced Formula: CaZn3Se4
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 215
  • Spacegroup Symbol: P-43m
  • Crystal System: cubic
  • Pointgroup: -43m