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-105706
  • 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: 3
  • Number of elements: 2
  • Element list: ['K', 'Pd']
  • Chemical System: K-Pd
  • Density: 2.750178811521685
  • Atomic Density: 0.026913014198955927
  • Unit Cell Volume: 111.47023435659551
  • Molar Volume: 22.376314728186873
  • Full Formula: K2 Pd1
  • Reduced Formula: K2Pd
  • Formula Anonymous: AB2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm