Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102233
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 4
  • Element list: ['Zn', 'Cu', 'Si', 'Se']
  • Chemical System: Cu-Se-Si-Zn
  • Density: 5.122102145767087
  • Atomic Density: 0.04600223161170026
  • Unit Cell Volume: 173.90460679227726
  • Molar Volume: 13.090975261444322
  • Full Formula: Zn1 Cu2 Si1 Se4
  • Reduced Formula: ZnCu2SiSe4
  • Formula Anonymous: ABC2D4
  • Spacegroup Number: 82
  • Spacegroup Symbol: I-4
  • Crystal System: tetragonal
  • Pointgroup: -4