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-110678
  • 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: 10
  • Number of elements: 4
  • Element list: ['K', 'In', 'As', 'Cl']
  • Chemical System: As-Cl-In-K
  • Density: 2.602611338488404
  • Atomic Density: 0.03260824898516549
  • Unit Cell Volume: 306.67086737927303
  • Molar Volume: 18.468151303492743
  • Full Formula: K2 In1 As1 Cl6
  • Reduced Formula: K2InAsCl6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m